0 B14R1.156 C#CCCC(=O)CCc1ccccc1 1458a_100000185753_100000753159 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.156 C#CCCC(=O)CCc1ccccc1 1458a_100000692101_100000765856 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.156 C#CCCC(=O)COc1ccccc1 1458a_100000186222_100000753159 [0,0,0,0,0,0|1,0,2]=3 3 B14R1.156 C#CCCC(=O)COc1ccccn1 1458a_100102699861_100000753159 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.156 C#CCCC(=O)COc1cccnc1 1458a_100015207166_100000753159 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.156 C#CCCC(=O)CSc1ccccc1 1458a_100000211596_100000753159 [0,0,0,0,0,0|1,1,2]=4 6 B14R1.156 C#CCNC(=O)CCc1ccccc1 11a_100000212058_100000185753 [0,0,0,0,0,0|2,0,2]=4 7 B14R1.156 C#CCNC(=O)CCc1ccccc1 1626a_100000212058_100000185753 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.156 C#CCNC(=O)CCc1ccccc1 240690a_100000212058_100000185753 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.156 C#CCNC(=O)CCc1ccccc1 527a_100000212058_100000185753 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.156 C#CCNC(=O)COc1ccccc1 11a_100000212058_100000186222 [0,0,0,0,0,0|1,0,2]=3 11 B14R1.156 C#CCNC(=O)COc1ccccc1 1626a_100000212058_100000186222 [0,0,0,0,0,0|1,0,2]=3 12 B14R1.156 C#CCNC(=O)COc1ccccc1 240690a_100000212058_100000186222 [0,0,0,0,0,0|1,0,2]=3 13 B14R1.156 C#CCNC(=O)COc1ccccc1 527a_100000212058_100000186222 [0,0,0,0,0,0|1,0,2]=3 14 B14R1.156 C#CCNC(=O)COc1ccccn1 1626a_100000212058_100102699861 [0,0,0,0,0,0|2,0,2]=4 15 B14R1.156 C#CCNC(=O)COc1ccccn1 240690a_100000212058_100102699861 [0,0,0,0,0,0|2,0,2]=4 16 B14R1.156 C#CCNC(=O)COc1ccccn1 527a_100000212058_100102699861 [0,0,0,0,0,0|2,0,2]=4 17 B14R1.156 C#CCNC(=O)COc1cccnc1 11a_100000212058_100015207166 [0,0,0,0,0,0|2,0,2]=4 18 B14R1.156 C#CCNC(=O)COc1cccnc1 1626a_100000212058_100015207166 [0,0,0,0,0,0|2,0,2]=4 19 B14R1.156 C#CCNC(=O)COc1cccnc1 240690a_100000212058_100015207166 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.156 C#CCNC(=O)COc1cccnc1 527a_100000212058_100015207166 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.156 C#CCNC(=O)CSc1ccccc1 11a_100000212058_100000211596 [0,0,0,0,0,0|1,1,2]=4 22 B14R1.156 C#CCNC(=O)CSc1ccccc1 1626a_100000212058_100000211596 [0,0,0,0,0,0|1,1,2]=4 23 B14R1.156 C#CCNC(=O)CSc1ccccc1 240690a_100000212058_100000211596 [0,0,0,0,0,0|1,1,2]=4 24 B14R1.156 C#CCNC(=O)CSc1ccccc1 527a_100000212058_100000211596 [0,0,0,0,0,0|1,1,2]=4 25 B14R1.156 C#CCOC(C)COc1ccccc1 34a_100000210911_100000184674 [0,0,0,0,0,0|1,0,3]=4 26 B14R1.156 C#CCOC(C)COc1ccccc1 7a_100000210911_100000038162 [0,0,0,0,0,0|1,0,3]=4 27 B14R1.156 C/C=C/CC(=O)CCc1ccccc1 1458a_100000185753_100102629194 [0,0,0,0,0,0|2,0,2]=4 28 B14R1.156 C/C=C/CC(=O)COc1ccccc1 1458a_100000186222_100102629194 [0,0,0,0,0,0|1,0,2]=3 29 B14R1.156 C/C=C/CC(=O)COc1ccccn1 1458a_100102699861_100102629194 [0,0,0,0,0,0|2,0,2]=4 30 B14R1.156 C/C=C/CC(=O)COc1cccnc1 1458a_100015207166_100102629194 [0,0,0,0,0,0|2,0,2]=4 31 B14R1.156 C/C=C/CC(=O)CSc1ccccc1 1458a_100000211596_100102629194 [0,0,0,0,0,0|1,1,2]=4 32 B14R1.156 C=C(CNc1ccccc1)OCOC 34a_100000106764_100000042856 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.156 C=C(COc1ccccc1)OCOC 34a_100000210340_100000042856 [0,0,0,0,0,0|2,0,1]=3 34 B14R1.156 C=C(COc1cccnc1)OCOC 34a_100000210849_100000042856 [0,0,0,0,0,0|3,0,1]=4 35 B14R1.156 C=C(COc1ccncc1)OCOC 34a_100000212176_100000042856 [0,0,0,0,0,0|3,0,1]=4 36 B14R1.156 C=C(CSc1ccccc1)OCOC 62a_100000042856_100000041952 [0,0,0,0,0,0|2,1,1]=4 37 B14R1.156 C=C(CSc1ccccc1)OCOC 62a_100000719477_100000042856 [0,0,0,0,0,0|2,1,1]=4 38 B14R1.156 C=CC=CC(=O)CCc1ccccc1 1458a_100016291481_100000765856 [0,0,0,0,0,0|2,0,1]=3 39 B14R1.156 C=CC=CC(=O)CCc1ccccn1 1458a_100016291481_100015183660 [0,0,0,0,0,0|3,0,1]=4 40 B14R1.156 C=CC=CC(=O)CCc1cccnc1 1458a_100016291481_200011713674 [0,0,0,0,0,0|3,0,1]=4 41 B14R1.156 C=CC=CC(=O)CCc1ccncc1 1458a_100016291481_100000723409 [0,0,0,0,0,0|3,0,1]=4 42 B14R1.156 C=CC=CC(=O)NCc1ccccc1 1626a_100015324214_100016291481 [0,0,0,0,0,0|3,0,1]=4 43 B14R1.156 C=CC=CC(=O)NNc1ccccc1 22a_100015195140_100016291481 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.156 C=CCCC(=NNc1ccccc1)C 4a_100015195140_100000762624 [0,0,0,0,0,0|4,0,0]=4 45 B14R1.156 C=CCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000754431 [0,0,0,0,0,0|2,0,1]=3 46 B14R1.156 C=CCCC(=O)C#Cc1ccccn1 1458a_102125277312_100000754431 [0,0,0,0,0,0|3,0,1]=4 47 B14R1.156 C=CCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000754431 [0,0,0,0,0,0|2,0,1]=3 48 B14R1.156 C=CCCC(=O)C=Cc1ccccn1 1458a_100000740811_100000754431 [0,0,0,0,0,0|3,0,1]=4 49 B14R1.156 C=CCCC(=O)C=Cc1cccnc1 1458a_100000735890_100000754431 [0,0,0,0,0,0|3,0,1]=4 50 B14R1.156 C=CCCC(=O)C=Cc1ccncc1 1458a_100000682801_100000754431 [0,0,0,0,0,0|3,0,1]=4 51 B14R1.156 C=CCCC(=O)CCc1ccccc1 1458a_100000185753_100000754431 [0,0,0,0,0,0|2,0,0]=2 52 B14R1.156 C=CCCC(=O)CCc1ccccc1 1458a_100000749702_100000765856 [0,0,0,0,0,0|2,0,0]=2 53 B14R1.156 C=CCCC(=O)CCc1ccccn1 1458a_100000749702_100015183660 [0,0,0,0,0,0|3,0,0]=3 54 B14R1.156 C=CCCC(=O)CCc1ccccn1 1458a_100015195070_100000754431 [0,0,0,0,0,0|3,0,0]=3 55 B14R1.156 C=CCCC(=O)CCc1cccnc1 1458a_100000198484_100000754431 [0,0,0,0,0,0|3,0,0]=3 56 B14R1.156 C=CCCC(=O)CCc1cccnc1 1458a_100000749702_200011713674 [0,0,0,0,0,0|3,0,0]=3 57 B14R1.156 C=CCCC(=O)CCc1ccncc1 1458a_100000749702_100000723409 [0,0,0,0,0,0|3,0,0]=3 58 B14R1.156 C=CCCC(=O)CCc1ccncc1 1458a_100011225043_100000754431 [0,0,0,0,0,0|3,0,0]=3 59 B14R1.156 C=CCCC(=O)COc1ccccc1 1458a_100000186222_100000754431 [0,0,0,0,0,0|1,0,0]=1 60 B14R1.156 C=CCCC(=O)COc1ccccn1 1458a_100102699861_100000754431 [0,0,0,0,0,0|2,0,0]=2 61 B14R1.156 C=CCCC(=O)COc1cccnc1 1458a_100015207166_100000754431 [0,0,0,0,0,0|2,0,0]=2 62 B14R1.156 C=CCCC(=O)CSc1ccccc1 1458a_100000211596_100000754431 [0,0,0,0,0,0|1,1,0]=2 63 B14R1.156 C=CCCC(=O)CSc1ccccn1 1458a_100000156281_100000754431 [0,0,0,0,0,0|2,1,0]=3 64 B14R1.156 C=CCCC(=O)CSc1ccncc1 1458a_100000211328_100000754431 [0,0,0,0,0,0|2,1,0]=3 65 B14R1.156 C=CCCC(=O)NCc1ccccc1 11a_100015324214_100000749702 [0,0,0,0,0,0|3,0,0]=3 66 B14R1.156 C=CCCC(=O)NCc1ccccc1 1626a_100015324214_100000749702 [0,0,0,0,0,0|3,0,0]=3 67 B14R1.156 C=CCCC(=O)NCc1ccccc1 240690a_100015324214_100000749702 [0,0,0,0,0,0|3,0,0]=3 68 B14R1.156 C=CCCC(=O)NCc1ccccc1 527a_100015324214_100000749702 [0,0,0,0,0,0|3,0,0]=3 69 B14R1.156 C=CCCC(=O)NCc1ccccn1 11a_100000210449_100000749702 [0,0,0,0,0,0|4,0,0]=4 70 B14R1.156 C=CCCC(=O)NCc1ccccn1 1626a_100000210449_100000749702 [0,0,0,0,0,0|4,0,0]=4 71 B14R1.156 C=CCCC(=O)NCc1ccccn1 240690a_100000210449_100000749702 [0,0,0,0,0,0|4,0,0]=4 72 B14R1.156 C=CCCC(=O)NCc1ccccn1 527a_100000210449_100000749702 [0,0,0,0,0,0|4,0,0]=4 73 B14R1.156 C=CCCC(=O)NCc1cccnc1 11a_100000210453_100000749702 [0,0,0,0,0,0|4,0,0]=4 74 B14R1.156 C=CCCC(=O)NCc1cccnc1 240690a_100000210453_100000749702 [0,0,0,0,0,0|4,0,0]=4 75 B14R1.156 C=CCCC(=O)NCc1cccnc1 527a_100000210453_100000749702 [0,0,0,0,0,0|4,0,0]=4 76 B14R1.156 C=CCCC(=O)NCc1ccncc1 11a_100000210450_100000749702 [0,0,0,0,0,0|4,0,0]=4 77 B14R1.156 C=CCCC(=O)NCc1ccncc1 1626a_100000210450_100000749702 [0,0,0,0,0,0|4,0,0]=4 78 B14R1.156 C=CCCC(=O)NCc1ccncc1 240690a_100000210450_100000749702 [0,0,0,0,0,0|4,0,0]=4 79 B14R1.156 C=CCCC(=O)NCc1ccncc1 527a_100000210450_100000749702 [0,0,0,0,0,0|4,0,0]=4 80 B14R1.156 C=CCCC(=O)NNc1ccccc1 22a_100015195140_100000749702 [0,0,0,0,0,0|3,0,0]=3 81 B14R1.156 C=CCCC(=O)NNc1ccccn1 22a_100000183288_100000749702 [0,0,0,0,0,0|4,0,0]=4 82 B14R1.156 C=CCCC(=O)NNc1cccnc1 22a_100000728903_100000749702 [0,0,0,0,0,0|4,0,0]=4 83 B14R1.156 C=CCCC(=O)NNc1ccncc1 22a_100000698918_100000749702 [0,0,0,0,0,0|4,0,0]=4 84 B14R1.156 C=CCCN(C)CCc1ccccc1 2230a_100000207497_100000754431 [0,0,0,0,0,0|4,0,0]=4 85 B14R1.156 C=CCCN(C)CCc1ccccc1 2230a_100020639649_100000765856 [0,0,0,0,0,0|4,0,0]=4 86 B14R1.156 C=CCCN(C)CCc1ccccc1 269982a_100000207497_100000754431 [0,0,0,0,0,0|4,0,0]=4 87 B14R1.156 C=CCCN(C)CCc1ccccc1 269982a_100020639649_100000765856 [0,0,0,0,0,0|4,0,0]=4 88 B14R1.156 C=CCCN(C)CSc1ccccc1 2230a_100020639649_100011218342 [0,0,0,0,0,0|3,1,0]=4 89 B14R1.156 C=CCCN(C)CSc1ccccc1 269982a_100020639649_100011218342 [0,0,0,0,0,0|3,1,0]=4 90 B14R1.156 C=CCNC(=O)C#Cc1ccccc1 240690a_100020586998_100000736102 [0,0,0,0,0,0|2,0,1]=3 91 B14R1.156 C=CCNC(=O)C=Cc1ccccc1 1626a_100020586998_100000210462 [0,0,0,0,0,0|2,0,1]=3 92 B14R1.156 C=CCNC(=O)C=Cc1ccccn1 240690a_100020586998_100000740811 [0,0,0,0,0,0|3,0,1]=4 93 B14R1.156 C=CCNC(=O)C=Cc1cccnc1 240690a_100020586998_100000735890 [0,0,0,0,0,0|3,0,1]=4 94 B14R1.156 C=CCNC(=O)C=Cc1ccncc1 240690a_100020586998_100000682801 [0,0,0,0,0,0|3,0,1]=4 95 B14R1.156 C=CCNC(=O)CCc1ccccc1 1626a_100020586998_100000185753 [0,0,0,0,0,0|2,0,0]=2 96 B14R1.156 C=CCNC(=O)CCc1ccccc1 240690a_100020586998_100000185753 [0,0,0,0,0,0|2,0,0]=2 97 B14R1.156 C=CCNC(=O)CCc1ccccc1 527a_100020586998_100000185753 [0,0,0,0,0,0|2,0,0]=2 98 B14R1.156 C=CCNC(=O)CCc1ccccn1 240690a_100020586998_100015195070 [0,0,0,0,0,0|3,0,0]=3 99 B14R1.156 C=CCNC(=O)CCc1ccccn1 527a_100020586998_100015195070 [0,0,0,0,0,0|3,0,0]=3 100 B14R1.156 C=CCNC(=O)CCc1cccnc1 1626a_100020586998_100000198484 [0,0,0,0,0,0|3,0,0]=3 101 B14R1.156 C=CCNC(=O)CCc1cccnc1 240690a_100020586998_100000198484 [0,0,0,0,0,0|3,0,0]=3 102 B14R1.156 C=CCNC(=O)CCc1cccnc1 527a_100020586998_100000198484 [0,0,0,0,0,0|3,0,0]=3 103 B14R1.156 C=CCNC(=O)CCc1ccncc1 240690a_100020586998_100011225043 [0,0,0,0,0,0|3,0,0]=3 104 B14R1.156 C=CCNC(=O)CCc1ccncc1 527a_100020586998_100011225043 [0,0,0,0,0,0|3,0,0]=3 105 B14R1.156 C=CCNC(=O)COc1ccccc1 1626a_100020586998_100000186222 [0,0,0,0,0,0|1,0,0]=1 106 B14R1.156 C=CCNC(=O)COc1ccccc1 240690a_100020586998_100000186222 [0,0,0,0,0,0|1,0,0]=1 107 B14R1.156 C=CCNC(=O)COc1ccccc1 527a_100020586998_100000186222 [0,0,0,0,0,0|1,0,0]=1 108 B14R1.156 C=CCNC(=O)COc1ccccc1 7a_100000210340_100000183597 [0,0,0,0,0,0|1,0,0]=1 109 B14R1.156 C=CCNC(=O)COc1ccccn1 1626a_100020586998_100102699861 [0,0,0,0,0,0|2,0,0]=2 110 B14R1.156 C=CCNC(=O)COc1ccccn1 240690a_100020586998_100102699861 [0,0,0,0,0,0|2,0,0]=2 111 B14R1.156 C=CCNC(=O)COc1ccccn1 527a_100020586998_100102699861 [0,0,0,0,0,0|2,0,0]=2 112 B14R1.156 C=CCNC(=O)COc1cccnc1 1626a_100020586998_100015207166 [0,0,0,0,0,0|2,0,0]=2 113 B14R1.156 C=CCNC(=O)COc1cccnc1 240690a_100020586998_100015207166 [0,0,0,0,0,0|2,0,0]=2 114 B14R1.156 C=CCNC(=O)COc1cccnc1 527a_100020586998_100015207166 [0,0,0,0,0,0|2,0,0]=2 115 B14R1.156 C=CCNC(=O)COc1cccnc1 7a_100000210849_100000183597 [0,0,0,0,0,0|2,0,0]=2 116 B14R1.156 C=CCNC(=O)COc1cncnc1 7a_100000754086_100000183597 [0,0,0,0,0,0|3,0,0]=3 117 B14R1.156 C=CCNC(=O)CSc1ccccc1 1626a_100020586998_100000211596 [0,0,0,0,0,0|1,1,0]=2 118 B14R1.156 C=CCNC(=O)CSc1ccccc1 240690a_100020586998_100000211596 [0,0,0,0,0,0|1,1,0]=2 119 B14R1.156 C=CCNC(=O)CSc1ccccc1 527a_100020586998_100000211596 [0,0,0,0,0,0|1,1,0]=2 120 B14R1.156 C=CCNC(=O)CSc1ccccc1 62a_100000183597_100000041952 [0,0,0,0,0,0|1,1,0]=2 121 B14R1.156 C=CCNC(=O)CSc1ccccc1 62a_100000719477_100000183597 [0,0,0,0,0,0|1,1,0]=2 122 B14R1.156 C=CCNC(=O)CSc1ccccn1 240690a_100020586998_100000156281 [0,0,0,0,0,0|2,1,0]=3 123 B14R1.156 C=CCNC(=O)CSc1ccccn1 527a_100020586998_100000156281 [0,0,0,0,0,0|2,1,0]=3 124 B14R1.156 C=CCNC(=O)CSc1ccccn1 62a_100000183597_100011216584 [0,0,0,0,0,0|2,1,0]=3 125 B14R1.156 C=CCNC(=O)CSc1ccccn1 62a_100011216584_100000183597 [0,0,0,0,0,0|2,1,0]=3 126 B14R1.156 C=CCNC(=O)CSc1cccnc1 62a_100000183597_100000210063 [0,0,0,0,0,0|2,1,0]=3 127 B14R1.156 C=CCNC(=O)CSc1cccnc1 62a_100000210063_100000183597 [0,0,0,0,0,0|2,1,0]=3 128 B14R1.156 C=CCNC(=O)CSc1cccnn1 62a_100000183597_100016991348 [0,0,0,0,0,0|3,1,0]=4 129 B14R1.156 C=CCNC(=O)CSc1cccnn1 62a_100016991348_100000183597 [0,0,0,0,0,0|3,1,0]=4 130 B14R1.156 C=CCNC(=O)CSc1ccncc1 1626a_100020586998_100000211328 [0,0,0,0,0,0|2,1,0]=3 131 B14R1.156 C=CCNC(=O)CSc1ccncc1 240690a_100020586998_100000211328 [0,0,0,0,0,0|2,1,0]=3 132 B14R1.156 C=CCNC(=O)CSc1ccncc1 527a_100020586998_100000211328 [0,0,0,0,0,0|2,1,0]=3 133 B14R1.156 C=CCNC(=O)CSc1ccncc1 62a_100000183597_100000728582 [0,0,0,0,0,0|2,1,0]=3 134 B14R1.156 C=CCNC(=O)CSc1ccncc1 62a_100000728582_100000183597 [0,0,0,0,0,0|2,1,0]=3 135 B14R1.156 C=CCNC(=O)CSc1ccncn1 62a_100000183597_100000703185 [0,0,0,0,0,0|3,1,0]=4 136 B14R1.156 C=CCNC(=O)CSc1ccncn1 62a_100000703185_100000183597 [0,0,0,0,0,0|3,1,0]=4 137 B14R1.156 C=CCNC(=O)CSc1ccnnc1 62a_100000183597_100000732662 [0,0,0,0,0,0|3,1,0]=4 138 B14R1.156 C=CCNC(=O)CSc1ccnnc1 62a_100000732662_100000183597 [0,0,0,0,0,0|3,1,0]=4 139 B14R1.156 C=CCNC(=O)CSc1cnccn1 62a_100000183597_100000211759 [0,0,0,0,0,0|3,1,0]=4 140 B14R1.156 C=CCNC(=O)CSc1cnccn1 62a_100000211759_100000183597 [0,0,0,0,0,0|3,1,0]=4 141 B14R1.156 C=CCNC(=O)CSc1cncnc1 62a_100000183597_100011206942 [0,0,0,0,0,0|3,1,0]=4 142 B14R1.156 C=CCNC(=O)CSc1cncnc1 62a_100011206942_100000183597 [0,0,0,0,0,0|3,1,0]=4 143 B14R1.156 C=CCNC(=O)CSc1ncccn1 240690a_100020586998_200000156282 [0,0,0,0,0,0|3,1,0]=4 144 B14R1.156 C=CCNC(=O)CSc1ncccn1 62a_100000183597_100000211032 [0,0,0,0,0,0|3,1,0]=4 145 B14R1.156 C=CCNC(=O)CSc1ncccn1 62a_100000211032_100000183597 [0,0,0,0,0,0|3,1,0]=4 146 B14R1.156 C=CCNC(=O)NCc1ccccc1 2708a_100015324214_100020586998 [0,0,0,0,0,0|3,0,0]=3 147 B14R1.156 C=CCNC(=O)NCc1ccccc1 273464a_100015324214_100020586998 [0,0,0,0,0,0|3,0,0]=3 148 B14R1.156 C=CCNC(=O)NCc1ccccc1 273464a_100020586998_100015324214 [0,0,0,0,0,0|3,0,0]=3 149 B14R1.156 C=CCNC(=O)NCc1ccccc1 512a_100015324214_100020586998 [0,0,0,0,0,0|3,0,0]=3 150 B14R1.156 C=CCNC(=O)NCc1ccccc1 512a_100020586998_100015324214 [0,0,0,0,0,0|3,0,0]=3 151 B14R1.156 C=CCNC(=O)NCc1ccccn1 2708a_100000210449_100020586998 [0,0,0,0,0,0|4,0,0]=4 152 B14R1.156 C=CCNC(=O)NCc1ccccn1 273464a_100000210449_100020586998 [0,0,0,0,0,0|4,0,0]=4 153 B14R1.156 C=CCNC(=O)NCc1ccccn1 273464a_100020586998_100000210449 [0,0,0,0,0,0|4,0,0]=4 154 B14R1.156 C=CCNC(=O)NCc1ccccn1 512a_100020586998_100000210449 [0,0,0,0,0,0|4,0,0]=4 155 B14R1.156 C=CCNC(=O)NCc1cccnc1 2708a_100000210453_100020586998 [0,0,0,0,0,0|4,0,0]=4 156 B14R1.156 C=CCNC(=O)NCc1cccnc1 273464a_100000210453_100020586998 [0,0,0,0,0,0|4,0,0]=4 157 B14R1.156 C=CCNC(=O)NCc1cccnc1 273464a_100020586998_100000210453 [0,0,0,0,0,0|4,0,0]=4 158 B14R1.156 C=CCNC(=O)NCc1cccnc1 512a_100000210453_100020586998 [0,0,0,0,0,0|4,0,0]=4 159 B14R1.156 C=CCNC(=O)NCc1cccnc1 512a_100020586998_100000210453 [0,0,0,0,0,0|4,0,0]=4 160 B14R1.156 C=CCNC(=O)NCc1ccncc1 2708a_100000210450_100020586998 [0,0,0,0,0,0|4,0,0]=4 161 B14R1.156 C=CCNC(=O)NCc1ccncc1 273464a_100000210450_100020586998 [0,0,0,0,0,0|4,0,0]=4 162 B14R1.156 C=CCNC(=O)NCc1ccncc1 273464a_100020586998_100000210450 [0,0,0,0,0,0|4,0,0]=4 163 B14R1.156 C=CCNC(=O)NCc1ccncc1 512a_100020586998_100000210450 [0,0,0,0,0,0|4,0,0]=4 164 B14R1.156 C=CCNC(=O)NNc1ccccc1 273464a_100020586998_100015195140 [0,0,0,0,0,0|3,0,0]=3 165 B14R1.156 C=CCNC(=O)NNc1ccccc1 512a_100020586998_100015195140 [0,0,0,0,0,0|3,0,0]=3 166 B14R1.156 C=CCNC(=O)NNc1ccccn1 273464a_100020586998_100000183288 [0,0,0,0,0,0|4,0,0]=4 167 B14R1.156 C=CCNC(=O)NNc1ccccn1 512a_100020586998_100000183288 [0,0,0,0,0,0|4,0,0]=4 168 B14R1.156 C=CCNC(=O)NNc1cccnc1 273464a_100020586998_100000728903 [0,0,0,0,0,0|4,0,0]=4 169 B14R1.156 C=CCNC(=O)NNc1cccnc1 512a_100020586998_100000728903 [0,0,0,0,0,0|4,0,0]=4 170 B14R1.156 C=CCNC(=O)NNc1ccncc1 273464a_100020586998_100000698918 [0,0,0,0,0,0|4,0,0]=4 171 B14R1.156 C=CCNC(=O)NNc1ccncc1 512a_100020586998_100000698918 [0,0,0,0,0,0|4,0,0]=4 172 B14R1.156 C=CCNC(C)CCc1ccccc1 2230a_100000210798_100000210623 [0,0,0,0,0,0|3,0,1]=4 173 B14R1.156 C=CCNC(C)CCc1ccccc1 270004a_100020586998_100000210092 [0,0,0,0,0,0|3,0,1]=4 174 B14R1.156 C=CCNC(C)CCc1ccccc1 34a_100000210798_100015514636 [0,0,0,0,0,0|3,0,1]=4 175 B14R1.156 C=CCNC(C)COc1ccccc1 2230a_100000746794_100000210623 [0,0,0,0,0,0|2,0,1]=3 176 B14R1.156 C=CCNC(C)COc1ccccc1 270004a_100020586998_100000150576 [0,0,0,0,0,0|2,0,1]=3 177 B14R1.156 C=CCNC(C)COc1ccccc1 34a_100000746794_100015514636 [0,0,0,0,0,0|2,0,1]=3 178 B14R1.156 C=CCNC(C)CSc1ccccc1 270004a_100020586998_100000150717 [0,0,0,0,0,0|2,1,1]=4 179 B14R1.156 C=CCOC(=O)CNc1ccccc1 34a_100000106764_100000033060 [0,0,0,0,0,0|1,0,0]=1 180 B14R1.156 C=CCOC(=O)COC1C=CCCC1 34a_100011215024_100000033060 [0,0,0,0,0,0|0,0,4]=4 181 B14R1.156 C=CCOC(=O)COC1CC=CCC1 34a_100000073881_100000033060 [0,0,0,0,0,0|0,0,4]=4 182 B14R1.156 C=CCOC(=O)COc1ccccc1 34a_100000210340_100000033060 [0,0,0,0,0,0|0,0,0]=0 183 B14R1.156 C=CCOC(=O)COc1ccccc1 7a_100000210340_100000033060 [0,0,0,0,0,0|0,0,0]=0 184 B14R1.156 C=CCOC(=O)COc1cccnc1 34a_100000210849_100000033060 [0,0,0,0,0,0|1,0,0]=1 185 B14R1.156 C=CCOC(=O)COc1cccnc1 7a_100000210849_100000033060 [0,0,0,0,0,0|1,0,0]=1 186 B14R1.156 C=CCOC(=O)COc1ccncc1 34a_100000212176_100000033060 [0,0,0,0,0,0|1,0,0]=1 187 B14R1.156 C=CCOC(=O)COc1ccnnc1 34a_100015204005_100000033060 [0,0,0,0,0,0|2,0,0]=2 188 B14R1.156 C=CCOC(=O)COc1cncnc1 7a_100000754086_100000033060 [0,0,0,0,0,0|2,0,0]=2 189 B14R1.156 C=CCOC(=O)CSc1ccccc1 62a_100000033060_100000041952 [0,0,0,0,0,0|0,1,0]=1 190 B14R1.156 C=CCOC(=O)CSc1ccccc1 62a_100000719477_100000033060 [0,0,0,0,0,0|0,1,0]=1 191 B14R1.156 C=CCOC(=O)CSc1ccccn1 62a_100000033060_100011216584 [0,0,0,0,0,0|1,1,0]=2 192 B14R1.156 C=CCOC(=O)CSc1ccccn1 62a_100011216584_100000033060 [0,0,0,0,0,0|1,1,0]=2 193 B14R1.156 C=CCOC(=O)CSc1cccnc1 62a_100000033060_100000210063 [0,0,0,0,0,0|1,1,0]=2 194 B14R1.156 C=CCOC(=O)CSc1cccnc1 62a_100000210063_100000033060 [0,0,0,0,0,0|1,1,0]=2 195 B14R1.156 C=CCOC(=O)CSc1cccnn1 62a_100000033060_100016991348 [0,0,0,0,0,0|2,1,0]=3 196 B14R1.156 C=CCOC(=O)CSc1cccnn1 62a_100016991348_100000033060 [0,0,0,0,0,0|2,1,0]=3 197 B14R1.156 C=CCOC(=O)CSc1ccncc1 62a_100000033060_100000728582 [0,0,0,0,0,0|1,1,0]=2 198 B14R1.156 C=CCOC(=O)CSc1ccncc1 62a_100000728582_100000033060 [0,0,0,0,0,0|1,1,0]=2 199 B14R1.156 C=CCOC(=O)CSc1ccncn1 62a_100000033060_100000703185 [0,0,0,0,0,0|2,1,0]=3 200 B14R1.156 C=CCOC(=O)CSc1ccncn1 62a_100000703185_100000033060 [0,0,0,0,0,0|2,1,0]=3 201 B14R1.156 C=CCOC(=O)CSc1ccnnc1 62a_100000033060_100000732662 [0,0,0,0,0,0|2,1,0]=3 202 B14R1.156 C=CCOC(=O)CSc1ccnnc1 62a_100000732662_100000033060 [0,0,0,0,0,0|2,1,0]=3 203 B14R1.156 C=CCOC(=O)CSc1cnccn1 62a_100000033060_100000211759 [0,0,0,0,0,0|2,1,0]=3 204 B14R1.156 C=CCOC(=O)CSc1cnccn1 62a_100000211759_100000033060 [0,0,0,0,0,0|2,1,0]=3 205 B14R1.156 C=CCOC(=O)CSc1cncnc1 62a_100000033060_100011206942 [0,0,0,0,0,0|2,1,0]=3 206 B14R1.156 C=CCOC(=O)CSc1cncnc1 62a_100011206942_100000033060 [0,0,0,0,0,0|2,1,0]=3 207 B14R1.156 C=CCOC(=O)CSc1cnnnc1 62a_100000033060_100009846058 [0,0,0,0,0,0|3,1,0]=4 208 B14R1.156 C=CCOC(=O)CSc1cnnnc1 62a_100009846058_100000033060 [0,0,0,0,0,0|3,1,0]=4 209 B14R1.156 C=CCOC(=O)CSc1ncccn1 62a_100000033060_100000211032 [0,0,0,0,0,0|2,1,0]=3 210 B14R1.156 C=CCOC(=O)CSc1ncccn1 62a_100000211032_100000033060 [0,0,0,0,0,0|2,1,0]=3 211 B14R1.156 C=CCOC(C)C#Cc1ccccc1 34a_200000065209_100015514636 [0,0,0,0,0,0|2,0,2]=4 212 B14R1.156 C=CCOC(C)C#Cc1ccccc1 7a_200000065209_100015514636 [0,0,0,0,0,0|2,0,2]=4 213 B14R1.156 C=CCOC(C)COc1ccccc1 34a_100000210911_100015514636 [0,0,0,0,0,0|1,0,1]=2 214 B14R1.156 C=CCOC(C)COc1ccccc1 7a_100000210911_100015514636 [0,0,0,0,0,0|1,0,1]=2 215 B14R1.156 C=CCO[C@@H](C)CCc1ccccc1 34a_100009815974_100015514636 [0,0,0,0,0,0|2,0,1]=3 216 B14R1.156 C=CCO[C@@H](C)CCc1ccccc1 7a_100009815974_100015514636 [0,0,0,0,0,0|2,0,1]=3 217 B14R1.156 CC#CCC(=O)COc1ccccc1 1458a_100000186222_100000748600 [0,0,0,0,0,0|1,0,3]=4 218 B14R1.156 CC(COc1ccccc1)NCC=O 2230a_100000746794_200015260668 [0,0,0,0,0,0|3,0,1]=4 219 B14R1.156 CC(COc1ccccc1)NCC=O 34a_100000746794_200009817547 [0,0,0,0,0,0|3,0,1]=4 220 B14R1.156 CC(COc1ccccc1)OCC#N 7a_100000210911_100011215382 [0,0,0,0,0,0|2,0,2]=4 221 B14R1.156 CC(COc1ccccc1)OCC=O 34a_100000210911_200009817547 [0,0,0,0,0,0|2,0,1]=3 222 B14R1.156 CC(COc1ccccc1)OCC=O 7a_100000210911_200015260668 [0,0,0,0,0,0|2,0,1]=3 223 B14R1.156 CC(COc1ccccc1)OCCF 34a_100000210911_100011217306 [0,0,0,0,0,0|2,0,2]=4 224 B14R1.156 CC(COc1ccccc1)OCCF 7a_100000210911_100011217306 [0,0,0,0,0,0|2,0,2]=4 225 B14R1.156 CC(COc1ccccc1)OCCO 34a_100000210911_100000211926 [0,0,0,0,0,0|2,0,2]=4 226 B14R1.156 CC(COc1ccccc1)OCCO 7a_100000210911_100000211926 [0,0,0,0,0,0|2,0,2]=4 227 B14R1.156 CC=CCC(=O)CCc1ccccc1 1458a_100000185753_100000070051 [0,0,0,0,0,0|2,0,2]=4 228 B14R1.156 CC=CCC(=O)CCc1ccccc1 1458a_100121576822_100000765856 [0,0,0,0,0,0|2,0,2]=4 229 B14R1.156 CC=CCC(=O)COc1ccccc1 1458a_100000186222_100000070051 [0,0,0,0,0,0|1,0,2]=3 230 B14R1.156 CC=CCC(=O)COc1ccccn1 1458a_100102699861_100000070051 [0,0,0,0,0,0|2,0,2]=4 231 B14R1.156 CC=CCC(=O)COc1cccnc1 1458a_100015207166_100000070051 [0,0,0,0,0,0|2,0,2]=4 232 B14R1.156 CC=CCC(=O)CSc1ccccc1 1458a_100000211596_100000070051 [0,0,0,0,0,0|1,1,2]=4 233 B14R1.156 CC=NNC(=O)CCc1ccccc1 4a_100000189782_200000210099 [0,0,0,0,0,0|3,0,1]=4 234 B14R1.156 CC=NNC(=O)COc1ccccc1 4a_100000186219_200000210099 [0,0,0,0,0,0|2,0,1]=3 235 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210211 [0,0,0,0,0,0|2,0,2]=4 236 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000210183_100000765856 [0,0,0,0,0,0|2,0,2]=4 237 B14R1.156 CCCCC(=O)COc1ccccc1 1458a_100000186222_100000210211 [0,0,0,0,0,0|1,0,2]=3 238 B14R1.156 CCCCC(=O)COc1ccccn1 1458a_100102699861_100000210211 [0,0,0,0,0,0|2,0,2]=4 239 B14R1.156 CCCCC(=O)COc1cccnc1 1458a_100015207166_100000210211 [0,0,0,0,0,0|2,0,2]=4 240 B14R1.156 CCCCC(=O)CSc1ccccc1 1458a_100000211596_100000210211 [0,0,0,0,0,0|1,1,2]=4 241 B14R1.156 CCCNC(=O)CCc1ccccc1 11a_100020643023_100000185753 [0,0,0,0,0,0|2,0,2]=4 242 B14R1.156 CCCNC(=O)CCc1ccccc1 1626a_100020643023_100000185753 [0,0,0,0,0,0|2,0,2]=4 243 B14R1.156 CCCNC(=O)CCc1ccccc1 240690a_100020643023_100000185753 [0,0,0,0,0,0|2,0,2]=4 244 B14R1.156 CCCNC(=O)CCc1ccccc1 527a_100020643023_100000185753 [0,0,0,0,0,0|2,0,2]=4 245 B14R1.156 CCCNC(=O)CNc1ccccc1 34a_100000106764_100000183358 [0,0,0,0,0,0|2,0,2]=4 246 B14R1.156 CCCNC(=O)COc1ccccc1 11a_100020643023_100000186222 [0,0,0,0,0,0|1,0,2]=3 247 B14R1.156 CCCNC(=O)COc1ccccc1 1626a_100020643023_100000186222 [0,0,0,0,0,0|1,0,2]=3 248 B14R1.156 CCCNC(=O)COc1ccccc1 240690a_100020643023_100000186222 [0,0,0,0,0,0|1,0,2]=3 249 B14R1.156 CCCNC(=O)COc1ccccc1 34a_100000210340_100000183358 [0,0,0,0,0,0|1,0,2]=3 250 B14R1.156 CCCNC(=O)COc1ccccc1 527a_100020643023_100000186222 [0,0,0,0,0,0|1,0,2]=3 251 B14R1.156 CCCNC(=O)COc1ccccc1 7a_100000210340_100000183358 [0,0,0,0,0,0|1,0,2]=3 252 B14R1.156 CCCNC(=O)COc1ccccn1 1626a_100020643023_100102699861 [0,0,0,0,0,0|2,0,2]=4 253 B14R1.156 CCCNC(=O)COc1ccccn1 240690a_100020643023_100102699861 [0,0,0,0,0,0|2,0,2]=4 254 B14R1.156 CCCNC(=O)COc1ccccn1 527a_100020643023_100102699861 [0,0,0,0,0,0|2,0,2]=4 255 B14R1.156 CCCNC(=O)COc1cccnc1 11a_100020643023_100015207166 [0,0,0,0,0,0|2,0,2]=4 256 B14R1.156 CCCNC(=O)COc1cccnc1 1626a_100020643023_100015207166 [0,0,0,0,0,0|2,0,2]=4 257 B14R1.156 CCCNC(=O)COc1cccnc1 240690a_100020643023_100015207166 [0,0,0,0,0,0|2,0,2]=4 258 B14R1.156 CCCNC(=O)COc1cccnc1 34a_100000210849_100000183358 [0,0,0,0,0,0|2,0,2]=4 259 B14R1.156 CCCNC(=O)COc1cccnc1 527a_100020643023_100015207166 [0,0,0,0,0,0|2,0,2]=4 260 B14R1.156 CCCNC(=O)COc1cccnc1 7a_100000210849_100000183358 [0,0,0,0,0,0|2,0,2]=4 261 B14R1.156 CCCNC(=O)COc1ccncc1 34a_100000212176_100000183358 [0,0,0,0,0,0|2,0,2]=4 262 B14R1.156 CCCNC(=O)CSc1ccccc1 11a_100020643023_100000211596 [0,0,0,0,0,0|1,1,2]=4 263 B14R1.156 CCCNC(=O)CSc1ccccc1 1626a_100020643023_100000211596 [0,0,0,0,0,0|1,1,2]=4 264 B14R1.156 CCCNC(=O)CSc1ccccc1 240690a_100020643023_100000211596 [0,0,0,0,0,0|1,1,2]=4 265 B14R1.156 CCCNC(=O)CSc1ccccc1 527a_100020643023_100000211596 [0,0,0,0,0,0|1,1,2]=4 266 B14R1.156 CCCNC(=O)CSc1ccccc1 62a_100000183358_100000041952 [0,0,0,0,0,0|1,1,2]=4 267 B14R1.156 CCCNC(=O)CSc1ccccc1 62a_100000719477_100000183358 [0,0,0,0,0,0|1,1,2]=4 268 B14R1.156 CCCOC(=O)CNc1ccccc1 34a_100000106764_200011215008 [0,0,0,0,0,0|1,0,2]=3 269 B14R1.156 CCCOC(=O)COc1ccccc1 34a_100000210340_200011215008 [0,0,0,0,0,0|0,0,2]=2 270 B14R1.156 CCCOC(=O)COc1ccccc1 7a_100000210340_200011215008 [0,0,0,0,0,0|0,0,2]=2 271 B14R1.156 CCCOC(=O)COc1cccnc1 34a_100000210849_200011215008 [0,0,0,0,0,0|1,0,2]=3 272 B14R1.156 CCCOC(=O)COc1cccnc1 7a_100000210849_200011215008 [0,0,0,0,0,0|1,0,2]=3 273 B14R1.156 CCCOC(=O)COc1ccncc1 34a_100000212176_200011215008 [0,0,0,0,0,0|1,0,2]=3 274 B14R1.156 CCCOC(=O)COc1ccnnc1 34a_100015204005_200011215008 [0,0,0,0,0,0|2,0,2]=4 275 B14R1.156 CCCOC(=O)COc1cncnc1 7a_100000754086_200011215008 [0,0,0,0,0,0|2,0,2]=4 276 B14R1.156 CCCOC(=O)CSc1ccccc1 62a_100000719477_200011215008 [0,0,0,0,0,0|0,1,2]=3 277 B14R1.156 CCCOC(=O)CSc1ccccc1 62a_200011215008_100000041952 [0,0,0,0,0,0|0,1,2]=3 278 B14R1.156 CCCOC(=O)CSc1ccccn1 62a_100011216584_200011215008 [0,0,0,0,0,0|1,1,2]=4 279 B14R1.156 CCCOC(=O)CSc1ccccn1 62a_200011215008_100011216584 [0,0,0,0,0,0|1,1,2]=4 280 B14R1.156 CCCOC(=O)CSc1cccnc1 62a_100000210063_200011215008 [0,0,0,0,0,0|1,1,2]=4 281 B14R1.156 CCCOC(=O)CSc1cccnc1 62a_200011215008_100000210063 [0,0,0,0,0,0|1,1,2]=4 282 B14R1.156 CCCOC(=O)CSc1ccncc1 62a_100000728582_200011215008 [0,0,0,0,0,0|1,1,2]=4 283 B14R1.156 CCCOC(=O)CSc1ccncc1 62a_200011215008_100000728582 [0,0,0,0,0,0|1,1,2]=4 284 B14R1.156 CCCOC(C)COc1ccccc1 34a_100000210911_100000210303 [0,0,0,0,0,0|1,0,3]=4 285 B14R1.156 CCCOC(C)COc1ccccc1 7a_100000210911_100000210303 [0,0,0,0,0,0|1,0,3]=4 286 B14R1.156 CCNNC(=O)COc1ccccc1 22a_100000756455_100000186222 [0,0,0,0,0,0|2,0,2]=4 287 B14R1.156 COCCC(=O)CCc1ccccc1 1458a_100000185753_100000233755 [0,0,0,0,0,0|3,0,1]=4 288 B14R1.156 COCCC(=O)CCc1ccccc1 1458a_100000749529_100000765856 [0,0,0,0,0,0|3,0,1]=4 289 B14R1.156 COCCC(=O)COc1ccccc1 1458a_100000186222_100000233755 [0,0,0,0,0,0|2,0,1]=3 290 B14R1.156 COCCC(=O)COc1ccccn1 1458a_100102699861_100000233755 [0,0,0,0,0,0|3,0,1]=4 291 B14R1.156 COCCC(=O)COc1cccnc1 1458a_100015207166_100000233755 [0,0,0,0,0,0|3,0,1]=4 292 B14R1.156 COCCC(=O)CSc1ccccc1 1458a_100000211596_100000233755 [0,0,0,0,0,0|2,1,1]=4 293 B14R1.156 CSCCC(=O)CCc1ccccc1 1458a_100000174002_100000765856 [0,0,0,0,0,0|3,0,1]=4 294 B14R1.156 CSCCC(=O)CCc1ccccc1 1458a_100000185753_100000751147 [0,0,0,0,0,0|3,0,1]=4 295 B14R1.156 CSCCC(=O)COc1ccccc1 1458a_100000186222_100000751147 [0,0,0,0,0,0|2,0,1]=3 296 B14R1.156 CSCCC(=O)COc1ccccn1 1458a_100102699861_100000751147 [0,0,0,0,0,0|3,0,1]=4 297 B14R1.156 CSCCC(=O)COc1cccnc1 1458a_100015207166_100000751147 [0,0,0,0,0,0|3,0,1]=4 298 B14R1.156 CSCCC(=O)CSc1ccccc1 1458a_100000211596_100000751147 [0,0,0,0,0,0|2,1,1]=4 299 B14R1.156 CSCOC(C)COc1ccccc1 34a_100000210911_100011218213 [0,0,0,0,0,0|2,0,2]=4 300 B14R1.156 C[C@@H](CCc1ccccc1)OCC=O 34a_100009815974_200009817547 [0,0,0,0,0,0|3,0,1]=4 301 B14R1.156 C[C@@H](CCc1ccccc1)OCC=O 7a_100009815974_200015260668 [0,0,0,0,0,0|3,0,1]=4 302 B14R1.156 N#CCCC(=O)CCc1ccccc1 1458a_100000185753_100011215226 [0,0,0,0,0,0|3,0,1]=4 303 B14R1.156 N#CCCC(=O)CCc1ccccc1 1458a_100011934036_100000765856 [0,0,0,0,0,0|3,0,1]=4 304 B14R1.156 N#CCCC(=O)COc1ccccc1 1458a_100000186222_100011215226 [0,0,0,0,0,0|2,0,1]=3 305 B14R1.156 N#CCCC(=O)COc1ccccn1 1458a_100102699861_100011215226 [0,0,0,0,0,0|3,0,1]=4 306 B14R1.156 N#CCCC(=O)COc1cccnc1 1458a_100015207166_100011215226 [0,0,0,0,0,0|3,0,1]=4 307 B14R1.156 N#CCCC(=O)CSc1ccccc1 1458a_100000211596_100011215226 [0,0,0,0,0,0|2,1,1]=4 308 B14R1.156 N#CCNC(=O)CCc1ccccc1 1626a_100000734998_100000185753 [0,0,0,0,0,0|3,0,1]=4 309 B14R1.156 N#CCNC(=O)CCc1ccccc1 527a_100000734998_100000185753 [0,0,0,0,0,0|3,0,1]=4 310 B14R1.156 N#CCNC(=O)COc1ccccc1 1626a_100000734998_100000186222 [0,0,0,0,0,0|2,0,1]=3 311 B14R1.156 N#CCNC(=O)COc1ccccc1 527a_100000734998_100000186222 [0,0,0,0,0,0|2,0,1]=3 312 B14R1.156 N#CCNC(=O)COc1ccccc1 7a_100000210340_100000736037 [0,0,0,0,0,0|2,0,1]=3 313 B14R1.156 N#CCNC(=O)COc1ccccn1 1626a_100000734998_100102699861 [0,0,0,0,0,0|3,0,1]=4 314 B14R1.156 N#CCNC(=O)COc1ccccn1 527a_100000734998_100102699861 [0,0,0,0,0,0|3,0,1]=4 315 B14R1.156 N#CCNC(=O)COc1cccnc1 1626a_100000734998_100015207166 [0,0,0,0,0,0|3,0,1]=4 316 B14R1.156 N#CCNC(=O)COc1cccnc1 527a_100000734998_100015207166 [0,0,0,0,0,0|3,0,1]=4 317 B14R1.156 N#CCNC(=O)COc1cccnc1 7a_100000210849_100000736037 [0,0,0,0,0,0|3,0,1]=4 318 B14R1.156 N#CCNC(=O)CSc1ccccc1 1626a_100000734998_100000211596 [0,0,0,0,0,0|2,1,1]=4 319 B14R1.156 N#CCNC(=O)CSc1ccccc1 527a_100000734998_100000211596 [0,0,0,0,0,0|2,1,1]=4 320 B14R1.156 N#CCNC(=O)CSc1ccccc1 62a_100000719477_100000736037 [0,0,0,0,0,0|2,1,1]=4 321 B14R1.156 N#CCNC(=O)CSc1ccccc1 62a_100000736037_100000041952 [0,0,0,0,0,0|2,1,1]=4 322 B14R1.156 O=C(CCCF)CCc1ccccc1 1458a_100000185753_100011934791 [0,0,0,0,0,0|3,0,1]=4 323 B14R1.156 O=C(CCCF)COc1ccccc1 1458a_100000186222_100011934791 [0,0,0,0,0,0|2,0,1]=3 324 B14R1.156 O=C(CCCF)COc1ccccn1 1458a_100102699861_100011934791 [0,0,0,0,0,0|3,0,1]=4 325 B14R1.156 O=C(CCCF)COc1cccnc1 1458a_100015207166_100011934791 [0,0,0,0,0,0|3,0,1]=4 326 B14R1.156 O=C(CCCF)CSc1ccccc1 1458a_100000211596_100011934791 [0,0,0,0,0,0|2,1,1]=4 327 B14R1.156 O=C(CCCO)CCc1ccccc1 1458a_100000185753_100011215043 [0,0,0,0,0,0|3,0,1]=4 328 B14R1.156 O=C(CCCO)COc1ccccc1 1458a_100000186222_100011215043 [0,0,0,0,0,0|2,0,1]=3 329 B14R1.156 O=C(CCCO)COc1ccccn1 1458a_100102699861_100011215043 [0,0,0,0,0,0|3,0,1]=4 330 B14R1.156 O=C(CCCO)COc1cccnc1 1458a_100015207166_100011215043 [0,0,0,0,0,0|3,0,1]=4 331 B14R1.156 O=C(CCCO)CSc1ccccc1 1458a_100000211596_100011215043 [0,0,0,0,0,0|2,1,1]=4 332 B14R1.156 O=C(CCc1ccccc1)NCCF 11a_100000724931_100000185753 [0,0,0,0,0,0|3,0,1]=4 333 B14R1.156 O=C(CCc1ccccc1)NCCF 1626a_100000724931_100000185753 [0,0,0,0,0,0|3,0,1]=4 334 B14R1.156 O=C(CCc1ccccc1)NCCF 240690a_100000724931_100000185753 [0,0,0,0,0,0|3,0,1]=4 335 B14R1.156 O=C(CCc1ccccc1)NCCF 527a_100000724931_100000185753 [0,0,0,0,0,0|3,0,1]=4 336 B14R1.156 O=C(CCc1ccccc1)NCCO 240690a_100000210304_100000185753 [0,0,0,0,0,0|3,0,1]=4 337 B14R1.156 O=C(CCc1ccccc1)NCCO 527a_100000210304_100000185753 [0,0,0,0,0,0|3,0,1]=4 338 B14R1.156 O=C(COc1ccccc1)NCCF 11a_100000724931_100000186222 [0,0,0,0,0,0|2,0,1]=3 339 B14R1.156 O=C(COc1ccccc1)NCCF 1626a_100000724931_100000186222 [0,0,0,0,0,0|2,0,1]=3 340 B14R1.156 O=C(COc1ccccc1)NCCF 240690a_100000724931_100000186222 [0,0,0,0,0,0|2,0,1]=3 341 B14R1.156 O=C(COc1ccccc1)NCCF 527a_100000724931_100000186222 [0,0,0,0,0,0|2,0,1]=3 342 B14R1.156 O=C(COc1ccccc1)NCCO 240690a_100000210304_100000186222 [0,0,0,0,0,0|2,0,1]=3 343 B14R1.156 O=C(COc1ccccc1)NCCO 527a_100000210304_100000186222 [0,0,0,0,0,0|2,0,1]=3 344 B14R1.156 O=C(COc1ccccn1)NCCF 1626a_100000724931_100102699861 [0,0,0,0,0,0|3,0,1]=4 345 B14R1.156 O=C(COc1ccccn1)NCCF 240690a_100000724931_100102699861 [0,0,0,0,0,0|3,0,1]=4 346 B14R1.156 O=C(COc1ccccn1)NCCF 527a_100000724931_100102699861 [0,0,0,0,0,0|3,0,1]=4 347 B14R1.156 O=C(COc1ccccn1)NCCO 240690a_100000210304_100102699861 [0,0,0,0,0,0|3,0,1]=4 348 B14R1.156 O=C(COc1ccccn1)NCCO 527a_100000210304_100102699861 [0,0,0,0,0,0|3,0,1]=4 349 B14R1.156 O=C(COc1cccnc1)NCCF 11a_100000724931_100015207166 [0,0,0,0,0,0|3,0,1]=4 350 B14R1.156 O=C(COc1cccnc1)NCCF 1626a_100000724931_100015207166 [0,0,0,0,0,0|3,0,1]=4 351 B14R1.156 O=C(COc1cccnc1)NCCF 240690a_100000724931_100015207166 [0,0,0,0,0,0|3,0,1]=4 352 B14R1.156 O=C(COc1cccnc1)NCCF 527a_100000724931_100015207166 [0,0,0,0,0,0|3,0,1]=4 353 B14R1.156 O=C(COc1cccnc1)NCCO 240690a_100000210304_100015207166 [0,0,0,0,0,0|3,0,1]=4 354 B14R1.156 O=C(COc1cccnc1)NCCO 527a_100000210304_100015207166 [0,0,0,0,0,0|3,0,1]=4 355 B14R1.156 O=C(CSc1ccccc1)NCCF 11a_100000724931_100000211596 [0,0,0,0,0,0|2,1,1]=4 356 B14R1.156 O=C(CSc1ccccc1)NCCF 1626a_100000724931_100000211596 [0,0,0,0,0,0|2,1,1]=4 357 B14R1.156 O=C(CSc1ccccc1)NCCF 240690a_100000724931_100000211596 [0,0,0,0,0,0|2,1,1]=4 358 B14R1.156 O=C(CSc1ccccc1)NCCF 527a_100000724931_100000211596 [0,0,0,0,0,0|2,1,1]=4 359 B14R1.156 O=C(CSc1ccccc1)NCCO 240690a_100000210304_100000211596 [0,0,0,0,0,0|2,1,1]=4 360 B14R1.156 O=C(CSc1ccccc1)NCCO 527a_100000210304_100000211596 [0,0,0,0,0,0|2,1,1]=4 361 B13R1.28 BrCCOCCOc1ccccc1 34a_100000211926_100000184471 [1,0,0,0,0,0|1,0,2]=4 362 B13R1.28 C#CCOCCOc1ccccc1 34a_100000210247_100000184471 [1,0,0,0,0,0|0,0,3]=4 363 B13R1.28 C#CCOCCOc1ccccc1 34a_100000210260_100000184674 [1,0,0,0,0,0|0,0,3]=4 364 B13R1.28 C#CCOCCOc1ccccc1 34a_100000210340_100010402529 [1,0,0,0,0,0|0,0,3]=4 365 B13R1.28 C#CCOCCOc1ccccc1 7a_100000210260_100000038162 [1,0,0,0,0,0|0,0,3]=4 366 B13R1.28 C#CCOCCOc1ccccc1 7a_100000210340_100010402529 [1,0,0,0,0,0|0,0,3]=4 367 B13R1.28 C=CCCC=NNc1ccccc1 4a_100015195140_100011216789 [1,0,0,0,0,0|3,0,0]=4 368 B13R1.28 C=CCCCCNc1ccccc1 34a_100000106764_100011215482 [1,0,0,0,0,0|2,0,1]=4 369 B13R1.28 C=CCCCCOc1ccccc1 34a_100000210340_100011215482 [1,0,0,0,0,0|1,0,1]=3 370 B13R1.28 C=CCCCCOc1ccccc1 7a_100000210340_100011215482 [1,0,0,0,0,0|1,0,1]=3 371 B13R1.28 C=CCCCCOc1cccnc1 34a_100000210849_100011215482 [1,0,0,0,0,0|2,0,1]=4 372 B13R1.28 C=CCCCCOc1cccnc1 7a_100000210849_100011215482 [1,0,0,0,0,0|2,0,1]=4 373 B13R1.28 C=CCCCCOc1ccncc1 34a_100000212176_100011215482 [1,0,0,0,0,0|2,0,1]=4 374 B13R1.28 C=CCCCCSc1ccccc1 62a_100000719477_100011215482 [1,0,0,0,0,0|1,1,1]=4 375 B13R1.28 C=CCCCCSc1ccccc1 62a_100011215482_100000041952 [1,0,0,0,0,0|1,1,1]=4 376 B13R1.28 C=CCCNCCc1ccccc1 2230a_100000106460_100000754431 [1,0,0,0,0,0|3,0,0]=4 377 B13R1.28 C=CCCNCCc1ccccc1 2230a_100015191253_100000765856 [1,0,0,0,0,0|3,0,0]=4 378 B13R1.28 C=CCCNCCc1ccccc1 34a_100000106460_100000754431 [1,0,0,0,0,0|3,0,0]=4 379 B13R1.28 C=CCCNCSc1ccccc1 2230a_100015191253_100011218342 [1,0,0,0,0,0|2,1,0]=4 380 B13R1.28 C=CCCOCCc1ccccc1 34a_100000210268_100000754431 [1,0,0,0,0,0|3,0,0]=4 381 B13R1.28 C=CCCOCCc1ccccc1 34a_100011205117_100000765856 [1,0,0,0,0,0|3,0,0]=4 382 B13R1.28 C=CCCOCCc1ccccc1 7a_100000210268_100000754431 [1,0,0,0,0,0|3,0,0]=4 383 B13R1.28 C=CCCSCCc1ccccc1 62a_100000754431_100011218657 [1,0,0,0,0,0|3,0,0]=4 384 B13R1.28 C=CCCSCCc1ccccc1 62a_100000765856_100000754431 [1,0,0,0,0,0|3,0,0]=4 385 B13R1.28 C=CCCSCSc1ccccc1 62a_100000754431_100011218342 [1,0,0,0,0,0|2,1,0]=4 386 B13R1.28 C=CCCSCSc1ccccc1 62a_100011218342_100000754431 [1,0,0,0,0,0|2,1,0]=4 387 B13R1.28 C=CCNCCCc1ccccc1 2230a_100000211184_100000210623 [1,0,0,0,0,0|2,0,1]=4 388 B13R1.28 C=CCNCCCc1ccccc1 2230a_100020586998_100000211621 [1,0,0,0,0,0|2,0,1]=4 389 B13R1.28 C=CCNCCCc1ccccc1 34a_100000211184_100015514636 [1,0,0,0,0,0|2,0,1]=4 390 B13R1.28 C=CCNCCOc1ccccc1 2230a_100000174943_100000210623 [1,0,0,0,0,0|1,0,1]=3 391 B13R1.28 C=CCNCCOc1ccccc1 2230a_100020586998_100000184471 [1,0,0,0,0,0|1,0,1]=3 392 B13R1.28 C=CCNCCOc1ccccc1 270004a_100020586998_100000758736 [1,0,0,0,0,0|1,0,1]=3 393 B13R1.28 C=CCNCCOc1ccccc1 34a_100000174943_100015514636 [1,0,0,0,0,0|1,0,1]=3 394 B13R1.28 C=CCNCCOc1ccccn1 2230a_106741647558_100000210623 [1,0,0,0,0,0|2,0,1]=4 395 B13R1.28 C=CCNCCOc1cccnc1 2230a_100000754688_100000210623 [1,0,0,0,0,0|2,0,1]=4 396 B13R1.28 C=CCNCCSc1ccccc1 2230a_100000189519_100000210623 [1,0,0,0,0,0|1,1,1]=4 397 B13R1.28 C=CCNCCSc1ccccc1 2230a_100020586998_100000246102 [1,0,0,0,0,0|1,1,1]=4 398 B13R1.28 C=CCOC/C=C/c1ccccc1 34a_100000210256_100015514636 [1,0,0,0,0,0|1,0,2]=4 399 B13R1.28 C=CCOC/C=C/c1ccccc1 34a_200000210373_100016265936 [1,0,0,0,0,0|1,0,2]=4 400 B13R1.28 C=CCOCC#Cc1ccccc1 34a_100011217464_100015514636 [1,0,0,0,0,0|1,0,2]=4 401 B13R1.28 C=CCOCC#Cc1ccccc1 34a_200000210373_100011352542 [1,0,0,0,0,0|1,0,2]=4 402 B13R1.28 C=CCOCC#Cc1ccccc1 7a_100011217464_100015514636 [1,0,0,0,0,0|1,0,2]=4 403 B13R1.28 C=CCOCCCc1ccccc1 34a_100000210828_100015514636 [1,0,0,0,0,0|1,0,1]=3 404 B13R1.28 C=CCOCCCc1ccccc1 34a_200000210373_100000211621 [1,0,0,0,0,0|1,0,1]=3 405 B13R1.28 C=CCOCCCc1ccccc1 7a_100000210828_100015514636 [1,0,0,0,0,0|1,0,1]=3 406 B13R1.28 C=CCOCCCc1ccccn1 34a_100011215068_100015514636 [1,0,0,0,0,0|2,0,1]=4 407 B13R1.28 C=CCOCCCc1cccnc1 34a_100000211284_100015514636 [1,0,0,0,0,0|2,0,1]=4 408 B13R1.28 C=CCOCCCc1ccncc1 34a_100000210659_100015514636 [1,0,0,0,0,0|2,0,1]=4 409 B13R1.28 C=CCOCCNc1ccccc1 34a_100000211345_100015514636 [1,0,0,0,0,0|1,0,1]=3 410 B13R1.28 C=CCOCCNc1ccncc1 34a_200011243140_100015514636 [1,0,0,0,0,0|2,0,1]=4 411 B13R1.28 C=CCOCCOc1ccccc1 34a_100000210260_100015514636 [1,0,0,0,0,0|0,0,1]=2 412 B13R1.28 C=CCOCCOc1ccccc1 34a_200000210373_100000184471 [1,0,0,0,0,0|0,0,1]=2 413 B13R1.28 C=CCOCCOc1ccccc1 7a_100000210260_100015514636 [1,0,0,0,0,0|0,0,1]=2 414 B13R1.28 C=CCOCCSc1ccccc1 34a_200000210373_100000246102 [1,0,0,0,0,0|0,1,1]=3 415 B13R1.28 C=CCOCCSc1ccccc1 7a_100000230494_100015514636 [1,0,0,0,0,0|0,1,1]=3 416 B13R1.28 C=CCOCCSc1ccccn1 7a_100000156319_100015514636 [1,0,0,0,0,0|1,1,1]=4 417 B13R1.28 C=CCOCOCc1ccccc1 34a_200000210373_100000763385 [1,0,0,0,0,0|2,0,1]=4 418 B13R1.28 C=CCOCSCc1ccccc1 34a_200000210373_200011217039 [1,0,0,0,0,0|2,0,1]=4 419 B13R1.28 C=CCSCCCc1ccccc1 62a_100000210623_100000211621 [1,0,0,0,0,0|1,1,1]=4 420 B13R1.28 C=CCSCCCc1ccccc1 62a_100000211621_100000210623 [1,0,0,0,0,0|1,1,1]=4 421 B13R1.28 C=CCSCCOc1ccccc1 62a_100000184471_100000210623 [1,0,0,0,0,0|0,1,1]=3 422 B13R1.28 C=CCSCCOc1ccccc1 62a_100000210623_100000184471 [1,0,0,0,0,0|0,1,1]=3 423 B13R1.28 C=CCSCCSc1ccccc1 62a_100000210623_100000246102 [1,0,0,0,0,0|0,2,1]=4 424 B13R1.28 C=CCSCCSc1ccccc1 62a_100000246102_100000210623 [1,0,0,0,0,0|0,2,1]=4 425 B13R1.28 CCCOCCOc1ccccc1 34a_100000210258_100000184471 [1,0,0,0,0,0|0,0,3]=4 426 B13R1.28 CCCOCCOc1ccccc1 34a_100000210260_100000210303 [1,0,0,0,0,0|0,0,3]=4 427 B13R1.28 CCCOCCOc1ccccc1 34a_100000210340_100011215938 [1,0,0,0,0,0|0,0,3]=4 428 B13R1.28 CCCOCCOc1ccccc1 7a_100000210260_100000210303 [1,0,0,0,0,0|0,0,3]=4 429 B13R1.28 CCCOCCOc1ccccc1 7a_100000210340_100011215938 [1,0,0,0,0,0|0,0,3]=4 430 B13R1.28 CSCOCCOc1ccccc1 34a_100000210260_100011218213 [1,0,0,0,0,0|1,0,2]=4 431 B13R1.28 FCCOCCOc1ccccc1 34a_100000210260_100011217306 [1,0,0,0,0,0|1,0,2]=4 432 B13R1.28 FCCOCCOc1ccccc1 7a_100000210260_100011217306 [1,0,0,0,0,0|1,0,2]=4 433 B13R1.28 N#CCOCCOc1ccccc1 7a_100000210260_100011215382 [1,0,0,0,0,0|1,0,2]=4 434 B13R1.28 N#CCOCCOc1ccccc1 7a_100000210340_200000047693 [1,0,0,0,0,0|1,0,2]=4 435 B13R1.28 NCCOCCOc1ccccc1 34a_100000210304_100000184471 [1,0,0,0,0,0|1,0,2]=4 436 B13R1.28 O=CCCCCOc1ccccc1 7a_100000210340_100000139335 [1,0,0,0,0,0|2,0,1]=4 437 B13R1.28 O=CCNCCOc1ccccc1 2230a_100000174943_200015260668 [1,0,0,0,0,0|2,0,1]=4 438 B13R1.28 O=CCNCCOc1ccccc1 34a_100000174943_200009817547 [1,0,0,0,0,0|2,0,1]=4 439 B13R1.28 O=CCOCCCc1ccccc1 34a_100000210828_200009817547 [1,0,0,0,0,0|2,0,1]=4 440 B13R1.28 O=CCOCCCc1ccccc1 7a_100000210828_200015260668 [1,0,0,0,0,0|2,0,1]=4 441 B13R1.28 O=CCOCCNc1ccccc1 34a_100000211345_200009817547 [1,0,0,0,0,0|2,0,1]=4 442 B13R1.28 O=CCOCCOc1ccccc1 34a_100000210260_200009817547 [1,0,0,0,0,0|1,0,1]=3 443 B13R1.28 O=CCOCCOc1ccccc1 7a_100000210260_200015260668 [1,0,0,0,0,0|1,0,1]=3 444 B13R1.28 O=CCOCCSc1ccccc1 7a_100000230494_200015260668 [1,0,0,0,0,0|1,1,1]=4 445 B13R1.28 O=CCSCCOc1ccccc1 62a_100000184471_200015260668 [1,0,0,0,0,0|1,1,1]=4 446 B13R1.28 O=CCSCCOc1ccccc1 62a_200015260668_100000184471 [1,0,0,0,0,0|1,1,1]=4 447 B13R1.28 OCCOCCOc1ccccc1 34a_100000210260_100000211926 [1,0,0,0,0,0|1,0,2]=4 448 B13R1.28 OCCOCCOc1ccccc1 34a_100000210340_100000692535 [1,0,0,0,0,0|1,0,2]=4 449 B13R1.28 OCCOCCOc1ccccc1 7a_100000210260_100000211926 [1,0,0,0,0,0|1,0,2]=4 450 B13R1.28 OCCOCCOc1ccccc1 7a_100000210340_100011215305 [1,0,0,0,0,0|1,0,2]=4 451 B13R1.42 C#CCC(=O)CCc1ccccc1 1458a_100000185753_100000184674 [1,0,0,0,0,0|1,0,2]=4 452 B13R1.42 C#CCC(=O)CCc1ccccc1 1458a_100011220946_100000765856 [1,0,0,0,0,0|1,0,2]=4 453 B13R1.42 C#CCC(=O)COc1ccccc1 1458a_100000186222_100000184674 [1,0,0,0,0,0|0,0,2]=3 454 B13R1.42 C#CCC(=O)COc1ccccn1 1458a_100102699861_100000184674 [1,0,0,0,0,0|1,0,2]=4 455 B13R1.42 C#CCC(=O)COc1cccnc1 1458a_100015207166_100000184674 [1,0,0,0,0,0|1,0,2]=4 456 B13R1.42 C#CCC(=O)CSc1ccccc1 1458a_100000211596_100000184674 [1,0,0,0,0,0|0,1,2]=4 457 B13R1.42 C=CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210623 [1,0,0,0,0,0|1,0,1]=3 458 B13R1.42 C=CCC(=O)C#Cc1ccccn1 1458a_102125277312_100000210623 [1,0,0,0,0,0|2,0,1]=4 459 B13R1.42 C=CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210623 [1,0,0,0,0,0|1,0,1]=3 460 B13R1.42 C=CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210623 [1,0,0,0,0,0|2,0,1]=4 461 B13R1.42 C=CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210623 [1,0,0,0,0,0|2,0,1]=4 462 B13R1.42 C=CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210623 [1,0,0,0,0,0|2,0,1]=4 463 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000185753_100000210623 [1,0,0,0,0,0|1,0,0]=2 464 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000210193_100000765856 [1,0,0,0,0,0|1,0,0]=2 465 B13R1.42 C=CCC(=O)CCc1ccccn1 1458a_100000210193_100015183660 [1,0,0,0,0,0|2,0,0]=3 466 B13R1.42 C=CCC(=O)CCc1ccccn1 1458a_100015195070_100000210623 [1,0,0,0,0,0|2,0,0]=3 467 B13R1.42 C=CCC(=O)CCc1cccnc1 1458a_100000198484_100000210623 [1,0,0,0,0,0|2,0,0]=3 468 B13R1.42 C=CCC(=O)CCc1cccnc1 1458a_100000210193_200011713674 [1,0,0,0,0,0|2,0,0]=3 469 B13R1.42 C=CCC(=O)CCc1ccncc1 1458a_100000210193_100000723409 [1,0,0,0,0,0|2,0,0]=3 470 B13R1.42 C=CCC(=O)CCc1ccncc1 1458a_100011225043_100000210623 [1,0,0,0,0,0|2,0,0]=3 471 B13R1.42 C=CCC(=O)COc1ccccc1 1458a_100000186222_100000210623 [1,0,0,0,0,0|0,0,0]=1 472 B13R1.42 C=CCC(=O)COc1ccccn1 1458a_100102699861_100000210623 [1,0,0,0,0,0|1,0,0]=2 473 B13R1.42 C=CCC(=O)COc1cccnc1 1458a_100015207166_100000210623 [1,0,0,0,0,0|1,0,0]=2 474 B13R1.42 C=CCC(=O)CSc1ccccc1 1458a_100000211596_100000210623 [1,0,0,0,0,0|0,1,0]=2 475 B13R1.42 C=CCC(=O)CSc1ccccn1 1458a_100000156281_100000210623 [1,0,0,0,0,0|1,1,0]=3 476 B13R1.42 C=CCC(=O)CSc1ccncc1 1458a_100000211328_100000210623 [1,0,0,0,0,0|1,1,0]=3 477 B13R1.42 C=CCC(=O)NCc1ccccc1 11a_100015324214_100000210193 [1,0,0,0,0,0|2,0,0]=3 478 B13R1.42 C=CCC(=O)NCc1ccccc1 1626a_100015324214_100000210193 [1,0,0,0,0,0|2,0,0]=3 479 B13R1.42 C=CCC(=O)NCc1ccccc1 240690a_100015324214_100000210193 [1,0,0,0,0,0|2,0,0]=3 480 B13R1.42 C=CCC(=O)NCc1ccccc1 527a_100015324214_100000210193 [1,0,0,0,0,0|2,0,0]=3 481 B13R1.42 C=CCC(=O)NCc1ccccn1 11a_100000210449_100000210193 [1,0,0,0,0,0|3,0,0]=4 482 B13R1.42 C=CCC(=O)NCc1ccccn1 1626a_100000210449_100000210193 [1,0,0,0,0,0|3,0,0]=4 483 B13R1.42 C=CCC(=O)NCc1ccccn1 240690a_100000210449_100000210193 [1,0,0,0,0,0|3,0,0]=4 484 B13R1.42 C=CCC(=O)NCc1ccccn1 527a_100000210449_100000210193 [1,0,0,0,0,0|3,0,0]=4 485 B13R1.42 C=CCC(=O)NCc1cccnc1 11a_100000210453_100000210193 [1,0,0,0,0,0|3,0,0]=4 486 B13R1.42 C=CCC(=O)NCc1cccnc1 240690a_100000210453_100000210193 [1,0,0,0,0,0|3,0,0]=4 487 B13R1.42 C=CCC(=O)NCc1cccnc1 527a_100000210453_100000210193 [1,0,0,0,0,0|3,0,0]=4 488 B13R1.42 C=CCC(=O)NCc1ccncc1 11a_100000210450_100000210193 [1,0,0,0,0,0|3,0,0]=4 489 B13R1.42 C=CCC(=O)NCc1ccncc1 1626a_100000210450_100000210193 [1,0,0,0,0,0|3,0,0]=4 490 B13R1.42 C=CCC(=O)NCc1ccncc1 240690a_100000210450_100000210193 [1,0,0,0,0,0|3,0,0]=4 491 B13R1.42 C=CCC(=O)NCc1ccncc1 527a_100000210450_100000210193 [1,0,0,0,0,0|3,0,0]=4 492 B13R1.42 C=CCC(=O)NNc1ccccc1 22a_100015195140_100000210193 [1,0,0,0,0,0|2,0,0]=3 493 B13R1.42 C=CCC(=O)NNc1ccccn1 22a_100000183288_100000210193 [1,0,0,0,0,0|3,0,0]=4 494 B13R1.42 C=CCC(=O)NNc1cccnc1 22a_100000728903_100000210193 [1,0,0,0,0,0|3,0,0]=4 495 B13R1.42 C=CCC(=O)NNc1ccncc1 22a_100000698918_100000210193 [1,0,0,0,0,0|3,0,0]=4 496 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000207497_100000210623 [1,0,0,0,0,0|3,0,0]=4 497 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000225617_100000765856 [1,0,0,0,0,0|3,0,0]=4 498 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000207497_100000210623 [1,0,0,0,0,0|3,0,0]=4 499 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000225617_100000765856 [1,0,0,0,0,0|3,0,0]=4 500 B13R1.42 C=CCN(C)CSc1ccccc1 2230a_100000225617_100011218342 [1,0,0,0,0,0|2,1,0]=4 501 B13R1.42 C=CCN(C)CSc1ccccc1 269982a_100000225617_100011218342 [1,0,0,0,0,0|2,1,0]=4 502 B13R1.42 C=COC(=O)CNc1ccccc1 34a_100000106764_100000036128 [1,0,0,0,0,0|1,0,0]=2 503 B13R1.42 C=COC(=O)COc1ccccc1 34a_100000210340_100000036128 [1,0,0,0,0,0|0,0,0]=1 504 B13R1.42 C=COC(=O)COc1cccnc1 34a_100000210849_100000036128 [1,0,0,0,0,0|1,0,0]=2 505 B13R1.42 C=COC(=O)COc1ccncc1 34a_100000212176_100000036128 [1,0,0,0,0,0|1,0,0]=2 506 B13R1.42 C=COC(=O)COc1ccnnc1 34a_100015204005_100000036128 [1,0,0,0,0,0|2,0,0]=3 507 B13R1.42 C=COC(=O)CSc1ccccc1 62a_100000036128_100000041952 [1,0,0,0,0,0|0,1,0]=2 508 B13R1.42 C=COC(=O)CSc1ccccc1 62a_100000719477_100000036128 [1,0,0,0,0,0|0,1,0]=2 509 B13R1.42 C=COC(=O)CSc1ccccn1 62a_100000036128_100011216584 [1,0,0,0,0,0|1,1,0]=3 510 B13R1.42 C=COC(=O)CSc1ccccn1 62a_100011216584_100000036128 [1,0,0,0,0,0|1,1,0]=3 511 B13R1.42 C=COC(=O)CSc1cccnc1 62a_100000036128_100000210063 [1,0,0,0,0,0|1,1,0]=3 512 B13R1.42 C=COC(=O)CSc1cccnc1 62a_100000210063_100000036128 [1,0,0,0,0,0|1,1,0]=3 513 B13R1.42 C=COC(=O)CSc1cccnn1 62a_100000036128_100016991348 [1,0,0,0,0,0|2,1,0]=4 514 B13R1.42 C=COC(=O)CSc1cccnn1 62a_100016991348_100000036128 [1,0,0,0,0,0|2,1,0]=4 515 B13R1.42 C=COC(=O)CSc1ccncc1 62a_100000036128_100000728582 [1,0,0,0,0,0|1,1,0]=3 516 B13R1.42 C=COC(=O)CSc1ccncc1 62a_100000728582_100000036128 [1,0,0,0,0,0|1,1,0]=3 517 B13R1.42 C=COC(=O)CSc1ccncn1 62a_100000036128_100000703185 [1,0,0,0,0,0|2,1,0]=4 518 B13R1.42 C=COC(=O)CSc1ccncn1 62a_100000703185_100000036128 [1,0,0,0,0,0|2,1,0]=4 519 B13R1.42 C=COC(=O)CSc1ccnnc1 62a_100000036128_100000732662 [1,0,0,0,0,0|2,1,0]=4 520 B13R1.42 C=COC(=O)CSc1ccnnc1 62a_100000732662_100000036128 [1,0,0,0,0,0|2,1,0]=4 521 B13R1.42 C=COC(=O)CSc1cnccn1 62a_100000036128_100000211759 [1,0,0,0,0,0|2,1,0]=4 522 B13R1.42 C=COC(=O)CSc1cnccn1 62a_100000211759_100000036128 [1,0,0,0,0,0|2,1,0]=4 523 B13R1.42 C=COC(=O)CSc1cncnc1 62a_100000036128_100011206942 [1,0,0,0,0,0|2,1,0]=4 524 B13R1.42 C=COC(=O)CSc1cncnc1 62a_100011206942_100000036128 [1,0,0,0,0,0|2,1,0]=4 525 B13R1.42 C=COC(=O)CSc1ncccn1 62a_100000036128_100000211032 [1,0,0,0,0,0|2,1,0]=4 526 B13R1.42 C=COC(=O)CSc1ncccn1 62a_100000211032_100000036128 [1,0,0,0,0,0|2,1,0]=4 527 B13R1.42 CC(COc1ccccc1)OCF 34a_100000210911_100015361967 [1,0,0,0,0,0|2,0,1]=4 528 B13R1.42 CC(COc1ccccc1)OCF 7a_100000210911_100015361967 [1,0,0,0,0,0|2,0,1]=4 529 B13R1.42 CC=CC(=O)CCc1ccccc1 1458a_100000210699_100000765856 [1,0,0,0,0,0|1,0,2]=4 530 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000185753_100000210303 [1,0,0,0,0,0|1,0,2]=4 531 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000211992_100000765856 [1,0,0,0,0,0|1,0,2]=4 532 B13R1.42 CCCC(=O)COc1ccccc1 1458a_100000186222_100000210303 [1,0,0,0,0,0|0,0,2]=3 533 B13R1.42 CCCC(=O)COc1ccccc1 7a_100000210340_100000747444 [1,0,0,0,0,0|0,0,2]=3 534 B13R1.42 CCCC(=O)COc1ccccn1 1458a_100102699861_100000210303 [1,0,0,0,0,0|1,0,2]=4 535 B13R1.42 CCCC(=O)COc1cccnc1 1458a_100015207166_100000210303 [1,0,0,0,0,0|1,0,2]=4 536 B13R1.42 CCCC(=O)COc1cccnc1 7a_100000210849_100000747444 [1,0,0,0,0,0|1,0,2]=4 537 B13R1.42 CCCC(=O)CSc1ccccc1 1458a_100000211596_100000210303 [1,0,0,0,0,0|0,1,2]=4 538 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000719477_100000747444 [1,0,0,0,0,0|0,1,2]=4 539 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000747444_100000041952 [1,0,0,0,0,0|0,1,2]=4 540 B13R1.42 CCNC(=O)CCc1ccccc1 11a_100015525214_100000185753 [1,0,0,0,0,0|2,0,1]=4 541 B13R1.42 CCNC(=O)CCc1ccccc1 240690a_100015525214_100000185753 [1,0,0,0,0,0|2,0,1]=4 542 B13R1.42 CCNC(=O)CCc1ccccc1 527a_100015525214_100000185753 [1,0,0,0,0,0|2,0,1]=4 543 B13R1.42 CCNC(=O)CNc1ccccc1 34a_100000106764_100000183381 [1,0,0,0,0,0|2,0,1]=4 544 B13R1.42 CCNC(=O)COc1ccccc1 11a_100015525214_100000186222 [1,0,0,0,0,0|1,0,1]=3 545 B13R1.42 CCNC(=O)COc1ccccc1 240690a_100015525214_100000186222 [1,0,0,0,0,0|1,0,1]=3 546 B13R1.42 CCNC(=O)COc1ccccc1 34a_100000210340_100000183381 [1,0,0,0,0,0|1,0,1]=3 547 B13R1.42 CCNC(=O)COc1ccccc1 527a_100015525214_100000186222 [1,0,0,0,0,0|1,0,1]=3 548 B13R1.42 CCNC(=O)COc1ccccc1 7a_100000210340_100000183381 [1,0,0,0,0,0|1,0,1]=3 549 B13R1.42 CCNC(=O)COc1ccccn1 240690a_100015525214_100102699861 [1,0,0,0,0,0|2,0,1]=4 550 B13R1.42 CCNC(=O)COc1ccccn1 527a_100015525214_100102699861 [1,0,0,0,0,0|2,0,1]=4 551 B13R1.42 CCNC(=O)COc1cccnc1 11a_100015525214_100015207166 [1,0,0,0,0,0|2,0,1]=4 552 B13R1.42 CCNC(=O)COc1cccnc1 240690a_100015525214_100015207166 [1,0,0,0,0,0|2,0,1]=4 553 B13R1.42 CCNC(=O)COc1cccnc1 34a_100000210849_100000183381 [1,0,0,0,0,0|2,0,1]=4 554 B13R1.42 CCNC(=O)COc1cccnc1 527a_100015525214_100015207166 [1,0,0,0,0,0|2,0,1]=4 555 B13R1.42 CCNC(=O)COc1cccnc1 7a_100000210849_100000183381 [1,0,0,0,0,0|2,0,1]=4 556 B13R1.42 CCNC(=O)COc1ccncc1 34a_100000212176_100000183381 [1,0,0,0,0,0|2,0,1]=4 557 B13R1.42 CCNC(=O)CSc1ccccc1 11a_100015525214_100000211596 [1,0,0,0,0,0|1,1,1]=4 558 B13R1.42 CCNC(=O)CSc1ccccc1 240690a_100015525214_100000211596 [1,0,0,0,0,0|1,1,1]=4 559 B13R1.42 CCNC(=O)CSc1ccccc1 527a_100015525214_100000211596 [1,0,0,0,0,0|1,1,1]=4 560 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000183381_100000041952 [1,0,0,0,0,0|1,1,1]=4 561 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000719477_100000183381 [1,0,0,0,0,0|1,1,1]=4 562 B13R1.42 CCOC(=O)C=Cc1ccccc1 271570a_100010199719_100000210277 [1,0,0,0,0,0|1,0,2]=4 563 B13R1.42 CCOC(=O)CNc1ccccc1 34a_100000106764_100000188475 [1,0,0,0,0,0|1,0,1]=3 564 B13R1.42 CCOC(=O)COc1ccccc1 34a_100000210340_100000188475 [1,0,0,0,0,0|0,0,1]=2 565 B13R1.42 CCOC(=O)COc1ccccc1 7a_100000210340_100000188475 [1,0,0,0,0,0|0,0,1]=2 566 B13R1.42 CCOC(=O)COc1cccnc1 34a_100000210849_100000188475 [1,0,0,0,0,0|1,0,1]=3 567 B13R1.42 CCOC(=O)COc1cccnc1 7a_100000210849_100000188475 [1,0,0,0,0,0|1,0,1]=3 568 B13R1.42 CCOC(=O)COc1ccncc1 34a_100000212176_100000188475 [1,0,0,0,0,0|1,0,1]=3 569 B13R1.42 CCOC(=O)COc1ccnnc1 34a_100015204005_100000188475 [1,0,0,0,0,0|2,0,1]=4 570 B13R1.42 CCOC(=O)COc1cncnc1 7a_100000754086_100000188475 [1,0,0,0,0,0|2,0,1]=4 571 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000188475_100000041952 [1,0,0,0,0,0|0,1,1]=3 572 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000719477_100000188475 [1,0,0,0,0,0|0,1,1]=3 573 B13R1.42 CCOC(=O)CSc1ccccn1 62a_100000188475_100011216584 [1,0,0,0,0,0|1,1,1]=4 574 B13R1.42 CCOC(=O)CSc1ccccn1 62a_100011216584_100000188475 [1,0,0,0,0,0|1,1,1]=4 575 B13R1.42 CCOC(=O)CSc1cccnc1 62a_100000188475_100000210063 [1,0,0,0,0,0|1,1,1]=4 576 B13R1.42 CCOC(=O)CSc1cccnc1 62a_100000210063_100000188475 [1,0,0,0,0,0|1,1,1]=4 577 B13R1.42 CCOC(=O)CSc1ccncc1 62a_100000188475_100000728582 [1,0,0,0,0,0|1,1,1]=4 578 B13R1.42 CCOC(=O)CSc1ccncc1 62a_100000728582_100000188475 [1,0,0,0,0,0|1,1,1]=4 579 B13R1.42 CCOC(C)COc1ccccc1 34a_100000210911_100000210202 [1,0,0,0,0,0|1,0,2]=4 580 B13R1.42 CCOC(C)COc1ccccc1 7a_100000210911_100000210202 [1,0,0,0,0,0|1,0,2]=4 581 B13R1.42 CNCC(=O)CCc1ccccc1 2230a_106832991635_100012361361 [1,0,0,0,0,0|2,0,1]=4 582 B13R1.42 CNCC(=O)CCc1ccccc1 34a_100102657272_100012361361 [1,0,0,0,0,0|2,0,1]=4 583 B13R1.42 CNCC(=O)CCc1ccccc1 7a_106832991635_100012361361 [1,0,0,0,0,0|2,0,1]=4 584 B13R1.42 CNNC(=O)COc1ccccc1 22a_100016993582_100000186222 [1,0,0,0,0,0|2,0,1]=4 585 B13R1.42 COCC(=O)CCc1ccccc1 1458a_100000210968_100000765856 [1,0,0,0,0,0|2,0,1]=4 586 B13R1.42 COCC(=O)CCc1ccccc1 34a_100138415774_100012361361 [1,0,0,0,0,0|2,0,1]=4 587 B13R1.42 CSCC(=O)CCc1ccccc1 1458a_100000184570_100000765856 [1,0,0,0,0,0|2,0,1]=4 588 B13R1.42 CSCC(=O)CCc1ccccc1 62a_100012361361_200000210301 [1,0,0,0,0,0|2,0,1]=4 589 B13R1.42 CSCC(=O)CCc1ccccc1 62a_200000210301_100012361361 [1,0,0,0,0,0|2,0,1]=4 590 B13R1.42 N#CCC(=O)CCc1ccccc1 1458a_100000185753_100011214920 [1,0,0,0,0,0|2,0,1]=4 591 B13R1.42 N#CCC(=O)CCc1ccccc1 1458a_100051588842_100000765856 [1,0,0,0,0,0|2,0,1]=4 592 B13R1.42 N#CCC(=O)COc1ccccc1 1458a_100000186222_100011214920 [1,0,0,0,0,0|1,0,1]=3 593 B13R1.42 N#CCC(=O)COc1ccccn1 1458a_100102699861_100011214920 [1,0,0,0,0,0|2,0,1]=4 594 B13R1.42 N#CCC(=O)COc1cccnc1 1458a_100015207166_100011214920 [1,0,0,0,0,0|2,0,1]=4 595 B13R1.42 N#CCC(=O)CSc1ccccc1 1458a_100000211596_100011214920 [1,0,0,0,0,0|1,1,1]=4 596 B13R1.42 O=C(C=CBr)CCc1ccccc1 1458a_100016273825_100000765856 [1,0,0,0,0,0|2,0,1]=4 597 B13R1.42 O=C(C=CCl)CCc1ccccc1 1458a_200016279998_100000765856 [1,0,0,0,0,0|2,0,1]=4 598 B13R1.42 O=C(C=CI)CCc1ccccc1 1458a_100016256311_100000765856 [1,0,0,0,0,0|2,0,1]=4 599 B13R1.42 O=C(CCF)CCc1ccccc1 1458a_100000185753_100011217306 [1,0,0,0,0,0|2,0,1]=4 600 B13R1.42 O=C(CCF)COc1ccccc1 1458a_100000186222_100011217306 [1,0,0,0,0,0|1,0,1]=3 601 B13R1.42 O=C(CCF)COc1ccccn1 1458a_100102699861_100011217306 [1,0,0,0,0,0|2,0,1]=4 602 B13R1.42 O=C(CCF)COc1cccnc1 1458a_100015207166_100011217306 [1,0,0,0,0,0|2,0,1]=4 603 B13R1.42 O=C(CCF)CSc1ccccc1 1458a_100000211596_100011217306 [1,0,0,0,0,0|1,1,1]=4 604 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100000185753_100000211926 [1,0,0,0,0,0|2,0,1]=4 605 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100011216618_100000765856 [1,0,0,0,0,0|2,0,1]=4 606 B13R1.42 O=C(CCO)COc1ccccc1 1458a_100000186222_100000211926 [1,0,0,0,0,0|1,0,1]=3 607 B13R1.42 O=C(CCO)COc1ccccn1 1458a_100102699861_100000211926 [1,0,0,0,0,0|2,0,1]=4 608 B13R1.42 O=C(CCO)COc1cccnc1 1458a_100015207166_100000211926 [1,0,0,0,0,0|2,0,1]=4 609 B13R1.42 O=C(CCO)CSc1ccccc1 1458a_100000211596_100000211926 [1,0,0,0,0,0|1,1,1]=4 610 B13R1.42 O=C(CNc1ccccc1)NCO 34a_100000106764_100000185155 [1,0,0,0,0,0|3,0,0]=4 611 B13R1.42 O=C(COc1ccccc1)NCO 34a_100000210340_100000185155 [1,0,0,0,0,0|2,0,0]=3 612 B13R1.42 O=C(COc1ccccc1)NCO 7a_100000210340_100000185155 [1,0,0,0,0,0|2,0,0]=3 613 B13R1.42 O=C(COc1cccnc1)NCO 34a_100000210849_100000185155 [1,0,0,0,0,0|3,0,0]=4 614 B13R1.42 O=C(COc1cccnc1)NCO 7a_100000210849_100000185155 [1,0,0,0,0,0|3,0,0]=4 615 B13R1.42 O=C(COc1ccncc1)NCO 34a_100000212176_100000185155 [1,0,0,0,0,0|3,0,0]=4 616 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000185155_100000041952 [1,0,0,0,0,0|2,1,0]=4 617 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000719477_100000185155 [1,0,0,0,0,0|2,1,0]=4 618 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_100012361361_200025704644 [1,0,0,0,0,0|2,0,1]=4 619 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_200025704644_100012361361 [1,0,0,0,0,0|2,0,1]=4 620 B15R1.78 C#CCCCC(=O)COc1ccccc1 1458a_100000186222_100000731252 [0,1,0,0,0,0|1,0,2]=4 621 B15R1.78 C#CCCNC(=O)COc1ccccc1 11a_100000755551_100000186222 [0,1,0,0,0,0|1,0,2]=4 622 B15R1.78 C#CCCNC(=O)COc1ccccc1 1626a_100000755551_100000186222 [0,1,0,0,0,0|1,0,2]=4 623 B15R1.78 C#CCCNC(=O)COc1ccccc1 240690a_100000755551_100000186222 [0,1,0,0,0,0|1,0,2]=4 624 B15R1.78 C#CCCNC(=O)COc1ccccc1 527a_100000755551_100000186222 [0,1,0,0,0,0|1,0,2]=4 625 B15R1.78 C#CCOCC(=O)CCc1ccccc1 1458a_100011251226_100000765856 [0,1,0,0,0,0|1,0,2]=4 626 B15R1.78 C#CCOCC(=O)CCc1ccccc1 34a_100000210247_100012361361 [0,1,0,0,0,0|1,0,2]=4 627 B15R1.78 C/C=C/C=CC(=O)CCc1ccccc1 1458a_100000185730_100000765856 [0,1,0,0,0,0|2,0,1]=4 628 B15R1.78 C/C=C/CNC(C)COc1ccccc1 34a_100000746794_100102629194 [0,1,0,0,0,0|2,0,1]=4 629 B15R1.78 C/C=C/COC(C)COc1ccccc1 34a_100000210911_100102629194 [0,1,0,0,0,0|1,0,1]=3 630 B15R1.78 C/C=C/COC(C)COc1ccccc1 7a_100000210911_100102629194 [0,1,0,0,0,0|1,0,1]=3 631 B15R1.78 C/C=C/CO[C@@H](C)CCc1ccccc1 34a_100009815974_100102629194 [0,1,0,0,0,0|2,0,1]=4 632 B15R1.78 C/C=C/CO[C@@H](C)CCc1ccccc1 7a_100009815974_100102629194 [0,1,0,0,0,0|2,0,1]=4 633 B15R1.78 C=CCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000757094 [0,1,0,0,0,0|2,0,1]=4 634 B15R1.78 C=CCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000757094 [0,1,0,0,0,0|2,0,1]=4 635 B15R1.78 C=CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000757094 [0,1,0,0,0,0|2,0,0]=3 636 B15R1.78 C=CCCCC(=O)CCc1ccccc1 1458a_100000766728_100000765856 [0,1,0,0,0,0|2,0,0]=3 637 B15R1.78 C=CCCCC(=O)CCc1ccccn1 1458a_100000766728_100015183660 [0,1,0,0,0,0|3,0,0]=4 638 B15R1.78 C=CCCCC(=O)CCc1ccccn1 1458a_100015195070_100000757094 [0,1,0,0,0,0|3,0,0]=4 639 B15R1.78 C=CCCCC(=O)CCc1cccnc1 1458a_100000198484_100000757094 [0,1,0,0,0,0|3,0,0]=4 640 B15R1.78 C=CCCCC(=O)CCc1cccnc1 1458a_100000766728_200011713674 [0,1,0,0,0,0|3,0,0]=4 641 B15R1.78 C=CCCCC(=O)CCc1ccncc1 1458a_100000766728_100000723409 [0,1,0,0,0,0|3,0,0]=4 642 B15R1.78 C=CCCCC(=O)CCc1ccncc1 1458a_100011225043_100000757094 [0,1,0,0,0,0|3,0,0]=4 643 B15R1.78 C=CCCCC(=O)COc1ccccc1 1458a_100000186222_100000757094 [0,1,0,0,0,0|1,0,0]=2 644 B15R1.78 C=CCCCC(=O)COc1ccccn1 1458a_100102699861_100000757094 [0,1,0,0,0,0|2,0,0]=3 645 B15R1.78 C=CCCCC(=O)COc1cccnc1 1458a_100015207166_100000757094 [0,1,0,0,0,0|2,0,0]=3 646 B15R1.78 C=CCCCC(=O)CSc1ccccc1 1458a_100000211596_100000757094 [0,1,0,0,0,0|1,1,0]=3 647 B15R1.78 C=CCCCC(=O)CSc1ccccn1 1458a_100000156281_100000757094 [0,1,0,0,0,0|2,1,0]=4 648 B15R1.78 C=CCCCC(=O)CSc1ccncc1 1458a_100000211328_100000757094 [0,1,0,0,0,0|2,1,0]=4 649 B15R1.78 C=CCCCC(=O)NCc1ccccc1 11a_100015324214_100000766728 [0,1,0,0,0,0|3,0,0]=4 650 B15R1.78 C=CCCCC(=O)NCc1ccccc1 1626a_100015324214_100000766728 [0,1,0,0,0,0|3,0,0]=4 651 B15R1.78 C=CCCCC(=O)NCc1ccccc1 240690a_100015324214_100000766728 [0,1,0,0,0,0|3,0,0]=4 652 B15R1.78 C=CCCCC(=O)NCc1ccccc1 527a_100015324214_100000766728 [0,1,0,0,0,0|3,0,0]=4 653 B15R1.78 C=CCCCC(=O)NNc1ccccc1 22a_100015195140_100000766728 [0,1,0,0,0,0|3,0,0]=4 654 B15R1.78 C=CCCNC(=O)C#Cc1ccccc1 240690a_100015191253_100000736102 [0,1,0,0,0,0|2,0,1]=4 655 B15R1.78 C=CCCNC(=O)C=Cc1ccccc1 11a_100015191253_100000210462 [0,1,0,0,0,0|2,0,1]=4 656 B15R1.78 C=CCCNC(=O)C=Cc1ccccc1 1626a_100015191253_100000210462 [0,1,0,0,0,0|2,0,1]=4 657 B15R1.78 C=CCCNC(=O)CCc1ccccc1 11a_100015191253_100000185753 [0,1,0,0,0,0|2,0,0]=3 658 B15R1.78 C=CCCNC(=O)CCc1ccccc1 1626a_100015191253_100000185753 [0,1,0,0,0,0|2,0,0]=3 659 B15R1.78 C=CCCNC(=O)CCc1ccccc1 240690a_100015191253_100000185753 [0,1,0,0,0,0|2,0,0]=3 660 B15R1.78 C=CCCNC(=O)CCc1ccccc1 527a_100015191253_100000185753 [0,1,0,0,0,0|2,0,0]=3 661 B15R1.78 C=CCCNC(=O)CCc1ccccn1 11a_100015191253_100015195070 [0,1,0,0,0,0|3,0,0]=4 662 B15R1.78 C=CCCNC(=O)CCc1ccccn1 240690a_100015191253_100015195070 [0,1,0,0,0,0|3,0,0]=4 663 B15R1.78 C=CCCNC(=O)CCc1ccccn1 527a_100015191253_100015195070 [0,1,0,0,0,0|3,0,0]=4 664 B15R1.78 C=CCCNC(=O)CCc1cccnc1 11a_100015191253_100000198484 [0,1,0,0,0,0|3,0,0]=4 665 B15R1.78 C=CCCNC(=O)CCc1cccnc1 1626a_100015191253_100000198484 [0,1,0,0,0,0|3,0,0]=4 666 B15R1.78 C=CCCNC(=O)CCc1cccnc1 240690a_100015191253_100000198484 [0,1,0,0,0,0|3,0,0]=4 667 B15R1.78 C=CCCNC(=O)CCc1cccnc1 527a_100015191253_100000198484 [0,1,0,0,0,0|3,0,0]=4 668 B15R1.78 C=CCCNC(=O)CCc1ccncc1 11a_100015191253_100011225043 [0,1,0,0,0,0|3,0,0]=4 669 B15R1.78 C=CCCNC(=O)CCc1ccncc1 240690a_100015191253_100011225043 [0,1,0,0,0,0|3,0,0]=4 670 B15R1.78 C=CCCNC(=O)CCc1ccncc1 527a_100015191253_100011225043 [0,1,0,0,0,0|3,0,0]=4 671 B15R1.78 C=CCCNC(=O)COc1ccccc1 11a_100015191253_100000186222 [0,1,0,0,0,0|1,0,0]=2 672 B15R1.78 C=CCCNC(=O)COc1ccccc1 1626a_100015191253_100000186222 [0,1,0,0,0,0|1,0,0]=2 673 B15R1.78 C=CCCNC(=O)COc1ccccc1 240690a_100015191253_100000186222 [0,1,0,0,0,0|1,0,0]=2 674 B15R1.78 C=CCCNC(=O)COc1ccccc1 527a_100015191253_100000186222 [0,1,0,0,0,0|1,0,0]=2 675 B15R1.78 C=CCCNC(=O)COc1ccccn1 1626a_100015191253_100102699861 [0,1,0,0,0,0|2,0,0]=3 676 B15R1.78 C=CCCNC(=O)COc1ccccn1 240690a_100015191253_100102699861 [0,1,0,0,0,0|2,0,0]=3 677 B15R1.78 C=CCCNC(=O)COc1ccccn1 527a_100015191253_100102699861 [0,1,0,0,0,0|2,0,0]=3 678 B15R1.78 C=CCCNC(=O)COc1cccnc1 11a_100015191253_100015207166 [0,1,0,0,0,0|2,0,0]=3 679 B15R1.78 C=CCCNC(=O)COc1cccnc1 1626a_100015191253_100015207166 [0,1,0,0,0,0|2,0,0]=3 680 B15R1.78 C=CCCNC(=O)COc1cccnc1 240690a_100015191253_100015207166 [0,1,0,0,0,0|2,0,0]=3 681 B15R1.78 C=CCCNC(=O)COc1cccnc1 527a_100015191253_100015207166 [0,1,0,0,0,0|2,0,0]=3 682 B15R1.78 C=CCCNC(=O)CSc1ccccc1 11a_100015191253_100000211596 [0,1,0,0,0,0|1,1,0]=3 683 B15R1.78 C=CCCNC(=O)CSc1ccccc1 1626a_100015191253_100000211596 [0,1,0,0,0,0|1,1,0]=3 684 B15R1.78 C=CCCNC(=O)CSc1ccccc1 240690a_100015191253_100000211596 [0,1,0,0,0,0|1,1,0]=3 685 B15R1.78 C=CCCNC(=O)CSc1ccccc1 527a_100015191253_100000211596 [0,1,0,0,0,0|1,1,0]=3 686 B15R1.78 C=CCCNC(=O)CSc1ccccn1 11a_100015191253_100000156281 [0,1,0,0,0,0|2,1,0]=4 687 B15R1.78 C=CCCNC(=O)CSc1ccccn1 240690a_100015191253_100000156281 [0,1,0,0,0,0|2,1,0]=4 688 B15R1.78 C=CCCNC(=O)CSc1ccccn1 527a_100015191253_100000156281 [0,1,0,0,0,0|2,1,0]=4 689 B15R1.78 C=CCCNC(=O)CSc1ccncc1 11a_100015191253_100000211328 [0,1,0,0,0,0|2,1,0]=4 690 B15R1.78 C=CCCNC(=O)CSc1ccncc1 1626a_100015191253_100000211328 [0,1,0,0,0,0|2,1,0]=4 691 B15R1.78 C=CCCNC(=O)CSc1ccncc1 240690a_100015191253_100000211328 [0,1,0,0,0,0|2,1,0]=4 692 B15R1.78 C=CCCNC(=O)CSc1ccncc1 527a_100015191253_100000211328 [0,1,0,0,0,0|2,1,0]=4 693 B15R1.78 C=CCCNC(=O)NCc1ccccc1 2708a_100015191253_100015324214 [0,1,0,0,0,0|3,0,0]=4 694 B15R1.78 C=CCCNC(=O)NCc1ccccc1 2708a_100015324214_100015191253 [0,1,0,0,0,0|3,0,0]=4 695 B15R1.78 C=CCCNC(=O)NCc1ccccc1 273464a_100015191253_100015324214 [0,1,0,0,0,0|3,0,0]=4 696 B15R1.78 C=CCCNC(=O)NCc1ccccc1 273464a_100015324214_100015191253 [0,1,0,0,0,0|3,0,0]=4 697 B15R1.78 C=CCCNC(=O)NCc1ccccc1 512a_100015191253_100015324214 [0,1,0,0,0,0|3,0,0]=4 698 B15R1.78 C=CCCNC(=O)NCc1ccccc1 512a_100015324214_100015191253 [0,1,0,0,0,0|3,0,0]=4 699 B15R1.78 C=CCCNC(=O)NNc1ccccc1 273464a_100015191253_100015195140 [0,1,0,0,0,0|3,0,0]=4 700 B15R1.78 C=CCCNC(=O)NNc1ccccc1 512a_100015191253_100015195140 [0,1,0,0,0,0|3,0,0]=4 701 B15R1.78 C=CCCNC(C)COc1ccccc1 2230a_100000746794_100000754431 [0,1,0,0,0,0|2,0,1]=4 702 B15R1.78 C=CCCNC(C)COc1ccccc1 270004a_100015191253_100000150576 [0,1,0,0,0,0|2,0,1]=4 703 B15R1.78 C=CCCNC(C)COc1ccccc1 34a_100000746794_100000754431 [0,1,0,0,0,0|2,0,1]=4 704 B15R1.78 C=CCCOC(C)COc1ccccc1 34a_100000210911_100000754431 [0,1,0,0,0,0|1,0,1]=3 705 B15R1.78 C=CCCOC(C)COc1ccccc1 7a_100000210911_100000754431 [0,1,0,0,0,0|1,0,1]=3 706 B15R1.78 C=CCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000754431 [0,1,0,0,0,0|2,0,1]=4 707 B15R1.78 C=CCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000754431 [0,1,0,0,0,0|2,0,1]=4 708 B15R1.78 C=CCNCC(=O)CCc1ccccc1 2230a_100020586998_100012361361 [0,1,0,0,0,0|2,0,0]=3 709 B15R1.78 C=CCNCC(=O)NCc1ccccc1 2230a_100000739245_100000210623 [0,1,0,0,0,0|3,0,0]=4 710 B15R1.78 C=CCNCC(=O)NCc1ccccc1 2230a_100020586998_100000183539 [0,1,0,0,0,0|3,0,0]=4 711 B15R1.78 C=CCNCC(=O)OCc1ccccc1 2230a_100020586998_100000753625 [0,1,0,0,0,0|3,0,0]=4 712 B15R1.78 C=CCNCC(O)COc1ccccc1 2230a_100000738913_100000210623 [0,1,0,0,0,0|1,0,2]=4 713 B15R1.78 C=CCNCC(O)COc1ccccc1 34a_100000738913_100015514636 [0,1,0,0,0,0|1,0,2]=4 714 B15R1.78 C=CCNNC(=O)C#Cc1ccccc1 22a_100020588587_100000736102 [0,1,0,0,0,0|2,0,1]=4 715 B15R1.78 C=CCNNC(=O)C=Cc1ccccc1 22a_100020588587_100000210462 [0,1,0,0,0,0|2,0,1]=4 716 B15R1.78 C=CCNNC(=O)CCc1ccccc1 22a_100020588587_100000185753 [0,1,0,0,0,0|2,0,0]=3 717 B15R1.78 C=CCNNC(=O)CCc1ccccn1 22a_100020588587_100015195070 [0,1,0,0,0,0|3,0,0]=4 718 B15R1.78 C=CCNNC(=O)CCc1cccnc1 22a_100020588587_100000198484 [0,1,0,0,0,0|3,0,0]=4 719 B15R1.78 C=CCNNC(=O)CCc1ccncc1 22a_100020588587_100011225043 [0,1,0,0,0,0|3,0,0]=4 720 B15R1.78 C=CCNNC(=O)COc1ccccc1 22a_100020588587_100000186222 [0,1,0,0,0,0|1,0,0]=2 721 B15R1.78 C=CCNNC(=O)COc1ccccn1 22a_100020588587_100102699861 [0,1,0,0,0,0|2,0,0]=3 722 B15R1.78 C=CCNNC(=O)COc1cccnc1 22a_100020588587_100015207166 [0,1,0,0,0,0|2,0,0]=3 723 B15R1.78 C=CCNNC(=O)CSc1ccccc1 22a_100020588587_100000211596 [0,1,0,0,0,0|1,1,0]=3 724 B15R1.78 C=CCNNC(=O)CSc1ccccn1 22a_100020588587_100000156281 [0,1,0,0,0,0|2,1,0]=4 725 B15R1.78 C=CCNNC(=O)CSc1ccncc1 22a_100020588587_100000211328 [0,1,0,0,0,0|2,1,0]=4 726 B15R1.78 C=CCNNC(=O)NCc1ccccc1 273464a_100015324214_100020588587 [0,1,0,0,0,0|3,0,0]=4 727 B15R1.78 C=CCNNC(=O)NCc1ccccc1 512a_100015324214_100020588587 [0,1,0,0,0,0|3,0,0]=4 728 B15R1.78 C=CCNNC(=O)NCc1ccccc1 512a_100020588587_100015324214 [0,1,0,0,0,0|3,0,0]=4 729 B15R1.78 C=CCNNC(=O)NNc1ccccc1 512a_100020588587_100015195140 [0,1,0,0,0,0|3,0,0]=4 730 B15R1.78 C=CCOCC(=O)CCc1ccccc1 34a_200000210373_100012361361 [0,1,0,0,0,0|1,0,0]=2 731 B15R1.78 C=CCOCC(=O)NCc1ccccc1 34a_200000210373_100000183539 [0,1,0,0,0,0|2,0,0]=3 732 B15R1.78 C=CCOCC(=O)NCc1ccccn1 34a_200000210373_100000684169 [0,1,0,0,0,0|3,0,0]=4 733 B15R1.78 C=CCOCC(=O)OCc1ccccc1 34a_200000210373_100000753625 [0,1,0,0,0,0|2,0,0]=3 734 B15R1.78 C=CCSCC(=O)CCc1ccccc1 1458a_100000230395_100000765856 [0,1,0,0,0,0|1,1,0]=3 735 B15R1.78 C=CCSCC(=O)CCc1ccccc1 62a_100000210623_100012361361 [0,1,0,0,0,0|1,1,0]=3 736 B15R1.78 C=CCSCC(=O)CCc1ccccc1 62a_100012361361_100000210623 [0,1,0,0,0,0|1,1,0]=3 737 B15R1.78 C=CCSCC(=O)CCc1ccccn1 1458a_100000230395_100015183660 [0,1,0,0,0,0|2,1,0]=4 738 B15R1.78 C=CCSCC(=O)CCc1cccnc1 1458a_100000230395_200011713674 [0,1,0,0,0,0|2,1,0]=4 739 B15R1.78 C=CCSCC(=O)CCc1ccncc1 1458a_100000230395_100000723409 [0,1,0,0,0,0|2,1,0]=4 740 B15R1.78 C=CCSCC(=O)NCc1ccccc1 11a_100015324214_100000230395 [0,1,0,0,0,0|2,1,0]=4 741 B15R1.78 C=CCSCC(=O)NCc1ccccc1 1626a_100015324214_100000230395 [0,1,0,0,0,0|2,1,0]=4 742 B15R1.78 C=CCSCC(=O)NCc1ccccc1 240690a_100015324214_100000230395 [0,1,0,0,0,0|2,1,0]=4 743 B15R1.78 C=CCSCC(=O)NCc1ccccc1 527a_100015324214_100000230395 [0,1,0,0,0,0|2,1,0]=4 744 B15R1.78 C=CCSCC(=O)NCc1ccccc1 62a_100000183539_100000210623 [0,1,0,0,0,0|2,1,0]=4 745 B15R1.78 C=CCSCC(=O)NCc1ccccc1 62a_100000210623_100000183539 [0,1,0,0,0,0|2,1,0]=4 746 B15R1.78 C=CCSCC(=O)NNc1ccccc1 22a_100015195140_100000230395 [0,1,0,0,0,0|2,1,0]=4 747 B15R1.78 C=CCSCC(=O)OCc1ccccc1 62a_100000210623_100000753625 [0,1,0,0,0,0|2,1,0]=4 748 B15R1.78 C=CCSCC(=O)OCc1ccccc1 62a_100000753625_100000210623 [0,1,0,0,0,0|2,1,0]=4 749 B15R1.78 C=COCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000039644 [0,1,0,0,0,0|2,0,1]=4 750 B15R1.78 C=COCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000039644 [0,1,0,0,0,0|2,0,1]=4 751 B15R1.78 C=COCCC(=O)CCc1ccccc1 1458a_100000185753_100000039644 [0,1,0,0,0,0|2,0,0]=3 752 B15R1.78 C=COCCC(=O)CCc1ccccn1 1458a_100015195070_100000039644 [0,1,0,0,0,0|3,0,0]=4 753 B15R1.78 C=COCCC(=O)CCc1cccnc1 1458a_100000198484_100000039644 [0,1,0,0,0,0|3,0,0]=4 754 B15R1.78 C=COCCC(=O)CCc1ccncc1 1458a_100011225043_100000039644 [0,1,0,0,0,0|3,0,0]=4 755 B15R1.78 C=COCCC(=O)COc1ccccc1 1458a_100000186222_100000039644 [0,1,0,0,0,0|1,0,0]=2 756 B15R1.78 C=COCCC(=O)COc1ccccn1 1458a_100102699861_100000039644 [0,1,0,0,0,0|2,0,0]=3 757 B15R1.78 C=COCCC(=O)COc1cccnc1 1458a_100015207166_100000039644 [0,1,0,0,0,0|2,0,0]=3 758 B15R1.78 C=COCCC(=O)CSc1ccccc1 1458a_100000211596_100000039644 [0,1,0,0,0,0|1,1,0]=3 759 B15R1.78 C=COCCC(=O)CSc1ccccn1 1458a_100000156281_100000039644 [0,1,0,0,0,0|2,1,0]=4 760 B15R1.78 C=COCCC(=O)CSc1ccncc1 1458a_100000211328_100000039644 [0,1,0,0,0,0|2,1,0]=4 761 B15R1.78 CC#CCNC(=O)COc1ccccc1 11a_100000685387_100000186222 [0,1,0,0,0,0|1,0,2]=4 762 B15R1.78 CC#CCNC(=O)COc1ccccc1 1626a_100000685387_100000186222 [0,1,0,0,0,0|1,0,2]=4 763 B15R1.78 CC#CCNC(=O)COc1ccccc1 527a_100000685387_100000186222 [0,1,0,0,0,0|1,0,2]=4 764 B15R1.78 CC/C=C\CC(=O)COc1ccccc1 1458a_100000186222_100103147603 [0,1,0,0,0,0|1,0,2]=4 765 B15R1.78 CC=CCNC(C)COc1ccccc1 2230a_100000746794_100000070051 [0,1,0,0,0,0|2,0,1]=4 766 B15R1.78 CC=CCNC(C)COc1ccccc1 34a_100000746794_100000070051 [0,1,0,0,0,0|2,0,1]=4 767 B15R1.78 CC=CCOC(C)COc1ccccc1 34a_100000210911_100000070051 [0,1,0,0,0,0|1,0,1]=3 768 B15R1.78 CC=CCOC(C)COc1ccccc1 7a_100000210911_100000070051 [0,1,0,0,0,0|1,0,1]=3 769 B15R1.78 CC=CCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000070051 [0,1,0,0,0,0|2,0,1]=4 770 B15R1.78 CC=CCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000070051 [0,1,0,0,0,0|2,0,1]=4 771 B15R1.78 CCC=NNC(=O)COc1ccccc1 4a_100000186219_100000210100 [0,1,0,0,0,0|2,0,1]=4 772 B15R1.78 CCCCCC(=O)COc1ccccc1 1458a_100000186222_100000210326 [0,1,0,0,0,0|1,0,2]=4 773 B15R1.78 CCCCCC(=O)COc1ccccc1 34a_100000210340_200012276598 [0,1,0,0,0,0|1,0,2]=4 774 B15R1.78 CCCCCC(=O)COc1ccccc1 7a_100000210340_200012276598 [0,1,0,0,0,0|1,0,2]=4 775 B15R1.78 CCCCNC(=O)COc1ccccc1 11a_100000102301_100000186222 [0,1,0,0,0,0|1,0,2]=4 776 B15R1.78 CCCCNC(=O)COc1ccccc1 1626a_100000102301_100000186222 [0,1,0,0,0,0|1,0,2]=4 777 B15R1.78 CCCCNC(=O)COc1ccccc1 240690a_100000102301_100000186222 [0,1,0,0,0,0|1,0,2]=4 778 B15R1.78 CCCCNC(=O)COc1ccccc1 34a_100000210340_100000182744 [0,1,0,0,0,0|1,0,2]=4 779 B15R1.78 CCCCNC(=O)COc1ccccc1 527a_100000102301_100000186222 [0,1,0,0,0,0|1,0,2]=4 780 B15R1.78 CCCCNC(=O)COc1ccccc1 7a_100000210340_100000182744 [0,1,0,0,0,0|1,0,2]=4 781 B15R1.78 CCCCOC(=O)CNc1ccccc1 34a_100000106764_100000211628 [0,1,0,0,0,0|1,0,2]=4 782 B15R1.78 CCCCOC(=O)COc1ccccc1 34a_100000210340_100000211628 [0,1,0,0,0,0|0,0,2]=3 783 B15R1.78 CCCCOC(=O)COc1ccccc1 7a_100000210340_100000211628 [0,1,0,0,0,0|0,0,2]=3 784 B15R1.78 CCCCOC(=O)COc1cccnc1 34a_100000210849_100000211628 [0,1,0,0,0,0|1,0,2]=4 785 B15R1.78 CCCCOC(=O)COc1cccnc1 7a_100000210849_100000211628 [0,1,0,0,0,0|1,0,2]=4 786 B15R1.78 CCCCOC(=O)COc1ccncc1 34a_100000212176_100000211628 [0,1,0,0,0,0|1,0,2]=4 787 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000211628_100000041952 [0,1,0,0,0,0|0,1,2]=4 788 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000719477_100000211628 [0,1,0,0,0,0|0,1,2]=4 789 B15R1.78 CCCNNC(=O)COc1ccccc1 22a_100000740057_100000186222 [0,1,0,0,0,0|1,0,2]=4 790 B15R1.78 CCCOCC(=O)CCc1ccccc1 1458a_100000745993_100000765856 [0,1,0,0,0,0|1,0,2]=4 791 B15R1.78 CCCOCC(=O)CCc1ccccc1 34a_100000210258_100012361361 [0,1,0,0,0,0|1,0,2]=4 792 B15R1.78 CCOCCC(=O)COc1ccccc1 1458a_100000186222_100011215890 [0,1,0,0,0,0|1,0,2]=4 793 B15R1.78 CCSCCC(=O)COc1ccccc1 1458a_100000186222_100000757381 [0,1,0,0,0,0|1,0,2]=4 794 B15R1.78 COCCCC(=O)COc1ccccc1 1458a_100000186222_100000740836 [0,1,0,0,0,0|1,0,2]=4 795 B15R1.78 COCCNC(=O)COc1ccccc1 1626a_100000209980_100000186222 [0,1,0,0,0,0|1,0,2]=4 796 B15R1.78 COCCNC(=O)COc1ccccc1 240690a_100000209980_100000186222 [0,1,0,0,0,0|1,0,2]=4 797 B15R1.78 COCCNC(=O)COc1ccccc1 34a_100000210340_100000183275 [0,1,0,0,0,0|1,0,2]=4 798 B15R1.78 COCCNC(=O)COc1ccccc1 527a_100000209980_100000186222 [0,1,0,0,0,0|1,0,2]=4 799 B15R1.78 COCCNC(=O)COc1ccccc1 7a_100000210340_100000183275 [0,1,0,0,0,0|1,0,2]=4 800 B15R1.78 COCCOC(=O)CNc1ccccc1 34a_100000106764_200000040189 [0,1,0,0,0,0|1,0,2]=4 801 B15R1.78 COCCOC(=O)COc1ccccc1 34a_100000210340_200000040189 [0,1,0,0,0,0|0,0,2]=3 802 B15R1.78 COCCOC(=O)COc1ccccc1 7a_100000210340_200000040189 [0,1,0,0,0,0|0,0,2]=3 803 B15R1.78 COCCOC(=O)COc1cccnc1 34a_100000210849_200000040189 [0,1,0,0,0,0|1,0,2]=4 804 B15R1.78 COCCOC(=O)COc1cccnc1 7a_100000210849_200000040189 [0,1,0,0,0,0|1,0,2]=4 805 B15R1.78 COCCOC(=O)COc1ccncc1 34a_100000212176_200000040189 [0,1,0,0,0,0|1,0,2]=4 806 B15R1.78 COCCOC(=O)CSc1ccccc1 62a_100000719477_200000040189 [0,1,0,0,0,0|0,1,2]=4 807 B15R1.78 COCCOC(=O)CSc1ccccc1 62a_200000040189_100000041952 [0,1,0,0,0,0|0,1,2]=4 808 B15R1.78 CSCCNC(=O)COc1ccccc1 11a_100020590264_100000186222 [0,1,0,0,0,0|1,0,2]=4 809 B15R1.78 CSCCNC(=O)COc1ccccc1 1626a_100020590264_100000186222 [0,1,0,0,0,0|1,0,2]=4 810 B15R1.78 CSCCNC(=O)COc1ccccc1 240690a_100020590264_100000186222 [0,1,0,0,0,0|1,0,2]=4 811 B15R1.78 CSCCNC(=O)COc1ccccc1 527a_100020590264_100000186222 [0,1,0,0,0,0|1,0,2]=4 812 B15R1.78 N#CCCCC(=O)COc1ccccc1 1458a_100000186222_100000211468 [0,1,0,0,0,0|1,0,2]=4 813 B15R1.78 N#CCCNC(=O)COc1ccccc1 11a_100000720768_100000186222 [0,1,0,0,0,0|1,0,2]=4 814 B15R1.78 N#CCCNC(=O)COc1ccccc1 1626a_100000720768_100000186222 [0,1,0,0,0,0|1,0,2]=4 815 B15R1.78 N#CCCNC(=O)COc1ccccc1 240690a_100000720768_100000186222 [0,1,0,0,0,0|1,0,2]=4 816 B15R1.78 N#CCCNC(=O)COc1ccccc1 527a_100000720768_100000186222 [0,1,0,0,0,0|1,0,2]=4 817 B15R1.78 NCCOCC(=O)CCc1ccccc1 34a_100000210304_100012361361 [0,1,0,0,0,0|2,0,1]=4 818 B15R1.78 O=C(CCCCF)COc1ccccc1 1458a_100000186222_100000729493 [0,1,0,0,0,0|1,0,2]=4 819 B15R1.78 O=C(CCCCO)COc1ccccc1 1458a_100000186222_100000210776 [0,1,0,0,0,0|1,0,2]=4 820 B15R1.78 O=C(CCc1ccccc1)COCCBr 34a_100000211926_100012361361 [0,1,0,0,0,0|2,0,1]=4 821 B15R1.78 O=C(CCc1ccccc1)COCCO 1458a_100000708028_100000765856 [0,1,0,0,0,0|2,0,1]=4 822 B15R1.78 O=C(COc1ccccc1)NCCCF 11a_100015189416_100000186222 [0,1,0,0,0,0|1,0,2]=4 823 B15R1.78 O=C(COc1ccccc1)NCCCF 1626a_100015189416_100000186222 [0,1,0,0,0,0|1,0,2]=4 824 B15R1.78 O=C(COc1ccccc1)NCCCF 240690a_100015189416_100000186222 [0,1,0,0,0,0|1,0,2]=4 825 B15R1.78 O=C(COc1ccccc1)NCCCF 527a_100015189416_100000186222 [0,1,0,0,0,0|1,0,2]=4 826 B15R1.78 O=C(COc1ccccc1)NCCCO 240690a_100000182051_100000186222 [0,1,0,0,0,0|1,0,2]=4 827 B15R1.78 O=C(COc1ccccc1)NCCCO 527a_100000182051_100000186222 [0,1,0,0,0,0|1,0,2]=4 828 B15R1.78 O=C(COc1ccccc1)NNCCO 22a_100000210001_100000186222 [0,1,0,0,0,0|2,0,1]=4 829 B15R1.78 O=CCSCC(=O)CCc1ccccc1 62a_100012361361_200015260668 [0,1,0,0,0,0|2,1,0]=4 830 B15R1.78 O=CCSCC(=O)CCc1ccccc1 62a_200015260668_100012361361 [0,1,0,0,0,0|2,1,0]=4 831 B15R1.115 C=CC=CC(=O)CC(=O)c1ccccc1 1458a_100016291481_100000211460 [0,1,0,0,0,0|2,0,1]=4 832 B15R1.115 C=CC=CC(=O)CC(C)c1ccccc1 1458a_100016291481_100000756946 [0,1,0,0,0,0|2,0,1]=4 833 B15R1.115 C=CC=CC(=O)CC(O)c1ccccc1 1458a_100016291481_100000185958 [0,1,0,0,0,0|2,0,1]=4 834 B15R1.115 C=CC=CC(=O)C[C@@H](O)c1ccccc1 1458a_100016291481_100011933945 [0,1,0,0,0,0|2,0,1]=4 835 B15R1.115 C=CCCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000754431 [0,1,0,0,0,0|2,0,1]=4 836 B15R1.115 C=CCCC(=O)CC(=O)c1ccccc1 1458a_100000749702_100000211460 [0,1,0,0,0,0|2,0,0]=3 837 B15R1.115 C=CCCC(=O)CC(=O)c1ccccn1 1458a_100000749702_100000027445 [0,1,0,0,0,0|3,0,0]=4 838 B15R1.115 C=CCCC(=O)CC(=O)c1cccnc1 1458a_100000749702_100015188593 [0,1,0,0,0,0|3,0,0]=4 839 B15R1.115 C=CCCC(=O)CC(=O)c1ccncc1 1458a_100000749702_100000027454 [0,1,0,0,0,0|3,0,0]=4 840 B15R1.115 C=CCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000754431 [0,1,0,0,0,0|2,0,0]=3 841 B15R1.115 C=CCCC(=O)CC(C)c1ccccc1 1458a_100000749702_100000756946 [0,1,0,0,0,0|2,0,0]=3 842 B15R1.115 C=CCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000754431 [0,1,0,0,0,0|2,0,0]=3 843 B15R1.115 C=CCCC(=O)CC(O)c1ccccc1 1458a_100000749702_100000185958 [0,1,0,0,0,0|2,0,0]=3 844 B15R1.115 C=CCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000754431 [0,1,0,0,0,0|2,0,0]=3 845 B15R1.115 C=CCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000749702_100011933945 [0,1,0,0,0,0|2,0,0]=3 846 B15R1.115 C=CCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000749702 [0,1,0,0,0,0|3,0,0]=4 847 B15R1.115 C=CCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000749702 [0,1,0,0,0,0|3,0,0]=4 848 B15R1.115 C=CCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000749702 [0,1,0,0,0,0|3,0,0]=4 849 B15R1.115 C=CCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000749702 [0,1,0,0,0,0|3,0,0]=4 850 B15R1.115 C=CCNC(=O)C=C(C)c1ccccc1 1626a_100020586998_100000743005 [0,1,0,0,0,0|2,0,1]=4 851 B15R1.115 C=CCNC(=O)C=C(C)c1ccccc1 240690a_100020586998_100000743005 [0,1,0,0,0,0|2,0,1]=4 852 B15R1.115 C=CCNC(=O)C=C(C)c1ccccc1 527a_100020586998_100000743005 [0,1,0,0,0,0|2,0,1]=4 853 B15R1.115 C=CCNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183597 [0,1,0,0,0,0|2,0,0]=3 854 B15R1.115 C=CCNC(=O)CC(C)c1ccccc1 1626a_100020586998_100000183687 [0,1,0,0,0,0|2,0,0]=3 855 B15R1.115 C=CCNC(=O)CC(C)c1ccccc1 240690a_100020586998_100000183687 [0,1,0,0,0,0|2,0,0]=3 856 B15R1.115 C=CCNC(=O)CC(C)c1ccccc1 527a_100020586998_100000183687 [0,1,0,0,0,0|2,0,0]=3 857 B15R1.115 C=CCNC(=O)CC(O)c1ccccc1 240690a_100020586998_100000690199 [0,1,0,0,0,0|2,0,0]=3 858 B15R1.115 C=CCNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000183597 [0,1,0,0,0,0|2,0,0]=3 859 B15R1.115 C=CCNC(=O)CN(C)c1ccccc1 240690a_100020586998_100000745425 [0,1,0,0,0,0|2,0,0]=3 860 B15R1.115 C=CCNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000183597 [0,1,0,0,0,0|2,0,0]=3 861 B15R1.115 C=CCNC(=O)CN(C)c1ccccc1 527a_100020586998_100000745425 [0,1,0,0,0,0|2,0,0]=3 862 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_100020586998 [0,1,0,0,0,0|3,0,0]=4 863 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100020586998 [0,1,0,0,0,0|3,0,0]=4 864 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 273464a_100020586998_100000751104 [0,1,0,0,0,0|3,0,0]=4 865 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100020586998 [0,1,0,0,0,0|3,0,0]=4 866 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 512a_100020586998_100000751104 [0,1,0,0,0,0|3,0,0]=4 867 B15R1.115 C=CCOC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000033060 [0,1,0,0,0,0|1,0,0]=2 868 B15R1.115 C=CCOC(=O)CN(C)c1ccccc1 2230a_100000210012_100000033060 [0,1,0,0,0,0|1,0,0]=2 869 B15R1.115 C=CCOC(=O)CN(C)c1ccccc1 269982a_100000210012_100000033060 [0,1,0,0,0,0|1,0,0]=2 870 B15R1.115 C=CCOC(=O)CN(C)c1ccccc1 34a_100000210012_100000033060 [0,1,0,0,0,0|1,0,0]=2 871 B15R1.115 CCCOC(=O)CC(=O)c1ccccc1 1458a_100000185807_200011215008 [0,1,0,0,0,0|1,0,2]=4 872 B15R1.115 CCCOC(=O)CN(C)c1ccccc1 2230a_100000210012_200011215008 [0,1,0,0,0,0|1,0,2]=4 873 B15R1.115 CCCOC(=O)CN(C)c1ccccc1 269982a_100000210012_200011215008 [0,1,0,0,0,0|1,0,2]=4 874 B15R1.115 CCCOC(=O)CN(C)c1ccccc1 34a_100000210012_200011215008 [0,1,0,0,0,0|1,0,2]=4 875 B15R1.127 C#CCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000753159 [0,1,0,0,0,0|1,0,2]=4 876 B15R1.127 C#CCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000753159 [0,1,0,0,0,0|1,0,2]=4 877 B15R1.127 C#CCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000753159 [0,1,0,0,0,0|1,0,2]=4 878 B15R1.127 C#CCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000753159 [0,1,0,0,0,0|1,0,2]=4 879 B15R1.127 C#CCNC(=O)COc1cccc(c1)Br 11a_100000212058_100000182359 [0,1,0,0,0,0|1,0,2]=4 880 B15R1.127 C#CCNC(=O)COc1cccc(c1)Br 1626a_100000212058_100000182359 [0,1,0,0,0,0|1,0,2]=4 881 B15R1.127 C#CCNC(=O)COc1cccc(c1)Br 240690a_100000212058_100000182359 [0,1,0,0,0,0|1,0,2]=4 882 B15R1.127 C#CCNC(=O)COc1cccc(c1)Br 527a_100000212058_100000182359 [0,1,0,0,0,0|1,0,2]=4 883 B15R1.127 C#CCNC(=O)COc1cccc(c1)C 11a_100000212058_100000183606 [0,1,0,0,0,0|1,0,2]=4 884 B15R1.127 C#CCNC(=O)COc1cccc(c1)C 1626a_100000212058_100000183606 [0,1,0,0,0,0|1,0,2]=4 885 B15R1.127 C#CCNC(=O)COc1cccc(c1)C 240690a_100000212058_100000183606 [0,1,0,0,0,0|1,0,2]=4 886 B15R1.127 C#CCNC(=O)COc1cccc(c1)C 527a_100000212058_100000183606 [0,1,0,0,0,0|1,0,2]=4 887 B15R1.127 C#CCNC(=O)COc1cccc(c1)Cl 11a_100000212058_100000184978 [0,1,0,0,0,0|1,0,2]=4 888 B15R1.127 C#CCNC(=O)COc1cccc(c1)Cl 1626a_100000212058_100000184978 [0,1,0,0,0,0|1,0,2]=4 889 B15R1.127 C#CCNC(=O)COc1cccc(c1)Cl 240690a_100000212058_100000184978 [0,1,0,0,0,0|1,0,2]=4 890 B15R1.127 C#CCNC(=O)COc1cccc(c1)Cl 527a_100000212058_100000184978 [0,1,0,0,0,0|1,0,2]=4 891 B15R1.127 C#CCNC(=O)COc1cccc(c1)F 11a_100000212058_100000182781 [0,1,0,0,0,0|1,0,2]=4 892 B15R1.127 C#CCNC(=O)COc1cccc(c1)F 1626a_100000212058_100000182781 [0,1,0,0,0,0|1,0,2]=4 893 B15R1.127 C#CCNC(=O)COc1cccc(c1)F 240690a_100000212058_100000182781 [0,1,0,0,0,0|1,0,2]=4 894 B15R1.127 C#CCNC(=O)COc1cccc(c1)F 527a_100000212058_100000182781 [0,1,0,0,0,0|1,0,2]=4 895 B15R1.127 C/C=C/CC(=O)COc1cccc(c1)Br 1458a_100000182359_100102629194 [0,1,0,0,0,0|1,0,2]=4 896 B15R1.127 C/C=C/CC(=O)COc1cccc(c1)C 1458a_100000183606_100102629194 [0,1,0,0,0,0|1,0,2]=4 897 B15R1.127 C/C=C/CC(=O)COc1cccc(c1)Cl 1458a_100000184978_100102629194 [0,1,0,0,0,0|1,0,2]=4 898 B15R1.127 C/C=C/CC(=O)COc1cccc(c1)F 1458a_100000182781_100102629194 [0,1,0,0,0,0|1,0,2]=4 899 B15R1.127 C=C(COc1cccc(c1)Br)OCOC 34a_100000210342_100000042856 [0,1,0,0,0,0|2,0,1]=4 900 B15R1.127 C=C(COc1cccc(c1)C)OCOC 34a_100000210337_100000042856 [0,1,0,0,0,0|2,0,1]=4 901 B15R1.127 C=C(COc1cccc(c1)Cl)OCOC 34a_100000210295_100000042856 [0,1,0,0,0,0|2,0,1]=4 902 B15R1.127 C=C(COc1cccc(c1)F)OCOC 34a_100000210426_100000042856 [0,1,0,0,0,0|2,0,1]=4 903 B15R1.127 C=C(COc1cccc(c1)I)OCOC 34a_100000211634_100000042856 [0,1,0,0,0,0|2,0,1]=4 904 B15R1.127 C=C(COc1cccc(c1)N)OCOC 34a_100000210217_100000042856 [0,1,0,0,0,0|2,0,1]=4 905 B15R1.127 C=CC=CC(=O)CCc1cccc(c1)Br 1458a_100016291481_100011740638 [0,1,0,0,0,0|2,0,1]=4 906 B15R1.127 C=CC=CC(=O)CCc1cccc(c1)C 1458a_100016291481_100011713685 [0,1,0,0,0,0|2,0,1]=4 907 B15R1.127 C=CC=CC(=O)CCc1cccc(c1)Cl 1458a_100016291481_100011713710 [0,1,0,0,0,0|2,0,1]=4 908 B15R1.127 C=CC=CC(=O)CCc1cccc(c1)F 1458a_100016291481_100011217235 [0,1,0,0,0,0|2,0,1]=4 909 B15R1.127 C=CCCC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_100000754431 [0,1,0,0,0,0|2,0,1]=4 910 B15R1.127 C=CCCC(=O)C#Cc1cccc(c1)C 1458a_100011892726_100000754431 [0,1,0,0,0,0|2,0,1]=4 911 B15R1.127 C=CCCC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_100000754431 [0,1,0,0,0,0|2,0,1]=4 912 B15R1.127 C=CCCC(=O)C#Cc1cccc(c1)F 1458a_100011892744_100000754431 [0,1,0,0,0,0|2,0,1]=4 913 B15R1.127 C=CCCC(=O)C#Cc1cccc(c1)O 1458a_200009909484_100000754431 [0,1,0,0,0,0|2,0,1]=4 914 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_100000754431 [0,1,0,0,0,0|2,0,1]=4 915 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)Br 6a_100000210085_100000762624 [0,1,0,0,0,0|2,0,1]=4 916 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)C 1458a_100000690095_100000754431 [0,1,0,0,0,0|2,0,1]=4 917 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_100000754431 [0,1,0,0,0,0|2,0,1]=4 918 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)F 1458a_100000718793_100000754431 [0,1,0,0,0,0|2,0,1]=4 919 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)F 6a_100000210812_100000762624 [0,1,0,0,0,0|2,0,1]=4 920 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)I 1458a_100020647043_100000754431 [0,1,0,0,0,0|2,0,1]=4 921 B15R1.127 C=CCCC(=O)C=Cc1cccc(c1)I 6a_100000014684_100000762624 [0,1,0,0,0,0|2,0,1]=4 922 B15R1.127 C=CCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000754431 [0,1,0,0,0,0|2,0,0]=3 923 B15R1.127 C=CCCC(=O)CCc1cccc(c1)Br 1458a_100000749702_100011740638 [0,1,0,0,0,0|2,0,0]=3 924 B15R1.127 C=CCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000754431 [0,1,0,0,0,0|2,0,0]=3 925 B15R1.127 C=CCCC(=O)CCc1cccc(c1)C 1458a_100000749702_100011713685 [0,1,0,0,0,0|2,0,0]=3 926 B15R1.127 C=CCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000754431 [0,1,0,0,0,0|2,0,0]=3 927 B15R1.127 C=CCCC(=O)CCc1cccc(c1)Cl 1458a_100000749702_100011713710 [0,1,0,0,0,0|2,0,0]=3 928 B15R1.127 C=CCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000754431 [0,1,0,0,0,0|2,0,0]=3 929 B15R1.127 C=CCCC(=O)CCc1cccc(c1)F 1458a_100000749702_100011217235 [0,1,0,0,0,0|2,0,0]=3 930 B15R1.127 C=CCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000754431 [0,1,0,0,0,0|2,0,0]=3 931 B15R1.127 C=CCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000754431 [0,1,0,0,0,0|2,0,0]=3 932 B15R1.127 C=CCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000754431 [0,1,0,0,0,0|1,0,0]=2 933 B15R1.127 C=CCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000754431 [0,1,0,0,0,0|1,0,0]=2 934 B15R1.127 C=CCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000754431 [0,1,0,0,0,0|1,0,0]=2 935 B15R1.127 C=CCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000754431 [0,1,0,0,0,0|1,0,0]=2 936 B15R1.127 C=CCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000754431 [0,1,0,0,0,0|1,1,0]=3 937 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000749702 [0,1,0,0,0,0|3,0,0]=4 938 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000749702 [0,1,0,0,0,0|3,0,0]=4 939 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000749702 [0,1,0,0,0,0|3,0,0]=4 940 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000749702 [0,1,0,0,0,0|3,0,0]=4 941 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000749702 [0,1,0,0,0,0|3,0,0]=4 942 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000749702 [0,1,0,0,0,0|3,0,0]=4 943 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000749702 [0,1,0,0,0,0|3,0,0]=4 944 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000749702 [0,1,0,0,0,0|3,0,0]=4 945 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000749702 [0,1,0,0,0,0|3,0,0]=4 946 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000749702 [0,1,0,0,0,0|3,0,0]=4 947 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000749702 [0,1,0,0,0,0|3,0,0]=4 948 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000749702 [0,1,0,0,0,0|3,0,0]=4 949 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000749702 [0,1,0,0,0,0|3,0,0]=4 950 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000749702 [0,1,0,0,0,0|3,0,0]=4 951 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000749702 [0,1,0,0,0,0|3,0,0]=4 952 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000749702 [0,1,0,0,0,0|3,0,0]=4 953 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000749702 [0,1,0,0,0,0|3,0,0]=4 954 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000749702 [0,1,0,0,0,0|3,0,0]=4 955 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000749702 [0,1,0,0,0,0|3,0,0]=4 956 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000749702 [0,1,0,0,0,0|3,0,0]=4 957 B15R1.127 C=CCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000749702 [0,1,0,0,0,0|3,0,0]=4 958 B15R1.127 C=CCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000749702 [0,1,0,0,0,0|3,0,0]=4 959 B15R1.127 C=CCCC(=O)NNc1cccc(c1)Br 22a_100000217339_100000749702 [0,1,0,0,0,0|3,0,0]=4 960 B15R1.127 C=CCCC(=O)NNc1cccc(c1)C 22a_100000681630_100000749702 [0,1,0,0,0,0|3,0,0]=4 961 B15R1.127 C=CCCC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000749702 [0,1,0,0,0,0|3,0,0]=4 962 B15R1.127 C=CCCC(=O)NNc1cccc(c1)F 22a_100000745080_100000749702 [0,1,0,0,0,0|3,0,0]=4 963 B15R1.127 C=CCCC(=O)NNc1cccc(c1)I 22a_100020605690_100000749702 [0,1,0,0,0,0|3,0,0]=4 964 B15R1.127 C=CCNC(=O)C#Cc1cccc(c1)C 240690a_100020586998_100011892726 [0,1,0,0,0,0|2,0,1]=4 965 B15R1.127 C=CCNC(=O)C#Cc1cccc(c1)Cl 240690a_100020586998_100011892777 [0,1,0,0,0,0|2,0,1]=4 966 B15R1.127 C=CCNC(=O)C#Cc1cccc(c1)F 240690a_100020586998_100011892744 [0,1,0,0,0,0|2,0,1]=4 967 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Br 1626a_100020586998_100016258244 [0,1,0,0,0,0|2,0,1]=4 968 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Br 240690a_100020586998_100016258244 [0,1,0,0,0,0|2,0,1]=4 969 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)C 1626a_100020586998_100000690095 [0,1,0,0,0,0|2,0,1]=4 970 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)C 240690a_100020586998_100000690095 [0,1,0,0,0,0|2,0,1]=4 971 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Cl 1626a_100020586998_100000184502 [0,1,0,0,0,0|2,0,1]=4 972 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Cl 240690a_100020586998_100000184502 [0,1,0,0,0,0|2,0,1]=4 973 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)F 1626a_100020586998_100000718793 [0,1,0,0,0,0|2,0,1]=4 974 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)F 240690a_100020586998_100000718793 [0,1,0,0,0,0|2,0,1]=4 975 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)I 1626a_100020586998_100020647043 [0,1,0,0,0,0|2,0,1]=4 976 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)I 240690a_100020586998_100020647043 [0,1,0,0,0,0|2,0,1]=4 977 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Br 1626a_100020586998_100000184314 [0,1,0,0,0,0|2,0,0]=3 978 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Br 240690a_100020586998_100000184314 [0,1,0,0,0,0|2,0,0]=3 979 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Br 527a_100020586998_100000184314 [0,1,0,0,0,0|2,0,0]=3 980 B15R1.127 C=CCNC(=O)CCc1cccc(c1)C 1626a_100020586998_100000234952 [0,1,0,0,0,0|2,0,0]=3 981 B15R1.127 C=CCNC(=O)CCc1cccc(c1)C 240690a_100020586998_100000234952 [0,1,0,0,0,0|2,0,0]=3 982 B15R1.127 C=CCNC(=O)CCc1cccc(c1)C 527a_100020586998_100000234952 [0,1,0,0,0,0|2,0,0]=3 983 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Cl 1626a_100020586998_100000235675 [0,1,0,0,0,0|2,0,0]=3 984 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Cl 240690a_100020586998_100000235675 [0,1,0,0,0,0|2,0,0]=3 985 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Cl 527a_100020586998_100000235675 [0,1,0,0,0,0|2,0,0]=3 986 B15R1.127 C=CCNC(=O)CCc1cccc(c1)F 1626a_100020586998_100000235673 [0,1,0,0,0,0|2,0,0]=3 987 B15R1.127 C=CCNC(=O)CCc1cccc(c1)F 240690a_100020586998_100000235673 [0,1,0,0,0,0|2,0,0]=3 988 B15R1.127 C=CCNC(=O)CCc1cccc(c1)F 527a_100020586998_100000235673 [0,1,0,0,0,0|2,0,0]=3 989 B15R1.127 C=CCNC(=O)CCc1cccc(c1)I 1626a_100020586998_100010007846 [0,1,0,0,0,0|2,0,0]=3 990 B15R1.127 C=CCNC(=O)CCc1cccc(c1)I 240690a_100020586998_100010007846 [0,1,0,0,0,0|2,0,0]=3 991 B15R1.127 C=CCNC(=O)CCc1cccc(c1)I 527a_100020586998_100010007846 [0,1,0,0,0,0|2,0,0]=3 992 B15R1.127 C=CCNC(=O)CCc1cccc(c1)O 240690a_100020586998_100011216126 [0,1,0,0,0,0|2,0,0]=3 993 B15R1.127 C=CCNC(=O)CCc1cccc(c1)O 527a_100020586998_100011216126 [0,1,0,0,0,0|2,0,0]=3 994 B15R1.127 C=CCNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000183597 [0,1,0,0,0,0|2,0,0]=3 995 B15R1.127 C=CCNC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000183597 [0,1,0,0,0,0|2,0,0]=3 996 B15R1.127 C=CCNC(=O)COc1cccc(c1)Br 1626a_100020586998_100000182359 [0,1,0,0,0,0|1,0,0]=2 997 B15R1.127 C=CCNC(=O)COc1cccc(c1)Br 240690a_100020586998_100000182359 [0,1,0,0,0,0|1,0,0]=2 998 B15R1.127 C=CCNC(=O)COc1cccc(c1)Br 527a_100020586998_100000182359 [0,1,0,0,0,0|1,0,0]=2 999 B15R1.127 C=CCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183597 [0,1,0,0,0,0|1,0,0]=2 1000 B15R1.127 C=CCNC(=O)COc1cccc(c1)C 1626a_100020586998_100000183606 [0,1,0,0,0,0|1,0,0]=2 1001 B15R1.127 C=CCNC(=O)COc1cccc(c1)C 240690a_100020586998_100000183606 [0,1,0,0,0,0|1,0,0]=2 1002 B15R1.127 C=CCNC(=O)COc1cccc(c1)C 527a_100020586998_100000183606 [0,1,0,0,0,0|1,0,0]=2 1003 B15R1.127 C=CCNC(=O)COc1cccc(c1)C 7a_100000210337_100000183597 [0,1,0,0,0,0|1,0,0]=2 1004 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl 1626a_100020586998_100000184978 [0,1,0,0,0,0|1,0,0]=2 1005 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl 240690a_100020586998_100000184978 [0,1,0,0,0,0|1,0,0]=2 1006 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl 527a_100020586998_100000184978 [0,1,0,0,0,0|1,0,0]=2 1007 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183597 [0,1,0,0,0,0|1,0,0]=2 1008 B15R1.127 C=CCNC(=O)COc1cccc(c1)F 1626a_100020586998_100000182781 [0,1,0,0,0,0|1,0,0]=2 1009 B15R1.127 C=CCNC(=O)COc1cccc(c1)F 240690a_100020586998_100000182781 [0,1,0,0,0,0|1,0,0]=2 1010 B15R1.127 C=CCNC(=O)COc1cccc(c1)F 527a_100020586998_100000182781 [0,1,0,0,0,0|1,0,0]=2 1011 B15R1.127 C=CCNC(=O)COc1cccc(c1)F 7a_100000210426_100000183597 [0,1,0,0,0,0|1,0,0]=2 1012 B15R1.127 C=CCNC(=O)COc1cccc(c1)I 7a_100000211634_100000183597 [0,1,0,0,0,0|1,0,0]=2 1013 B15R1.127 C=CCNC(=O)COc1cncc(c1)Br 7a_100000754920_100000183597 [0,1,0,0,0,0|2,0,0]=3 1014 B15R1.127 C=CCNC(=O)COc1cncc(c1)C 7a_100011830280_100000183597 [0,1,0,0,0,0|2,0,0]=3 1015 B15R1.127 C=CCNC(=O)COc1cncc(c1)Cl 7a_100000032511_100000183597 [0,1,0,0,0,0|2,0,0]=3 1016 B15R1.127 C=CCNC(=O)COc1cncc(c1)F 7a_100011830296_100000183597 [0,1,0,0,0,0|2,0,0]=3 1017 B15R1.127 C=CCNC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000183597 [0,1,0,0,0,0|2,1,0]=4 1018 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)C 62a_100000183597_100000750283 [0,1,0,0,0,0|2,1,0]=4 1019 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)C 62a_100000750283_100000183597 [0,1,0,0,0,0|2,1,0]=4 1020 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)Cl 62a_100000183597_100010167805 [0,1,0,0,0,0|2,1,0]=4 1021 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000183597 [0,1,0,0,0,0|2,1,0]=4 1022 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)F 62a_100000183597_100000764206 [0,1,0,0,0,0|2,1,0]=4 1023 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)F 62a_100000764206_100000183597 [0,1,0,0,0,0|2,1,0]=4 1024 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)N 62a_100000183597_100009814236 [0,1,0,0,0,0|2,1,0]=4 1025 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)N 62a_100009814236_100000183597 [0,1,0,0,0,0|2,1,0]=4 1026 B15R1.127 C=CCNC(=O)CSc1cc(ccn1)O 62a_100000183597_100000762945 [0,1,0,0,0,0|2,1,0]=4 1027 B15R1.127 C=CCNC(=O)CSc1cc[nH]c(=O)c1 62a_100000183597_100009816521 [0,1,0,0,0,0|2,1,0]=4 1028 B15R1.127 C=CCNC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000183597 [0,1,0,0,0,0|2,1,0]=4 1029 B15R1.127 C=CCNC(=O)CSc1ccc[n+](c1)C 62a_100000183597_100009996589 [0,1,0,0,0,0|2,1,0]=4 1030 B15R1.127 C=CCNC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000183597 [0,1,0,0,0,0|2,1,0]=4 1031 B15R1.127 C=CCNC(=O)CSc1ccc[n+](c1)[O-] 62a_100000183597_100009815978 [0,1,0,0,0,0|2,1,0]=4 1032 B15R1.127 C=CCNC(=O)CSc1cccc(=O)[nH]1 62a_100000183597_100000752884 [0,1,0,0,0,0|2,1,0]=4 1033 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Br 1626a_100020586998_100000760868 [0,1,0,0,0,0|1,1,0]=3 1034 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Br 240690a_100020586998_100000760868 [0,1,0,0,0,0|1,1,0]=3 1035 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Br 527a_100020586998_100000760868 [0,1,0,0,0,0|1,1,0]=3 1036 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Br 62a_100000183597_100000691529 [0,1,0,0,0,0|1,1,0]=3 1037 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000183597 [0,1,0,0,0,0|1,1,0]=3 1038 B15R1.127 C=CCNC(=O)CSc1cccc(c1)C 62a_100000183597_100011215228 [0,1,0,0,0,0|1,1,0]=3 1039 B15R1.127 C=CCNC(=O)CSc1cccc(c1)C 62a_100011215228_100000183597 [0,1,0,0,0,0|1,1,0]=3 1040 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Cl 62a_100000183597_100000699651 [0,1,0,0,0,0|1,1,0]=3 1041 B15R1.127 C=CCNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000183597 [0,1,0,0,0,0|1,1,0]=3 1042 B15R1.127 C=CCNC(=O)CSc1cccc(c1)F 62a_100000183597_100000685547 [0,1,0,0,0,0|1,1,0]=3 1043 B15R1.127 C=CCNC(=O)CSc1cccc(c1)F 62a_100000685547_100000183597 [0,1,0,0,0,0|1,1,0]=3 1044 B15R1.127 C=CCNC(=O)CSc1cccc(c1)N 62a_100000183597_100000210019 [0,1,0,0,0,0|1,1,0]=3 1045 B15R1.127 C=CCNC(=O)CSc1cccc(c1)N 62a_100000210019_100000183597 [0,1,0,0,0,0|1,1,0]=3 1046 B15R1.127 C=CCNC(=O)CSc1cccc(c1)O 62a_100000183597_100000211634 [0,1,0,0,0,0|1,1,0]=3 1047 B15R1.127 C=CCNC(=O)CSc1cccc(c1)[S] 62a_100000183597_114929384022 [0,1,0,0,0,0|1,1,0]=3 1048 B15R1.127 C=CCNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000183597 [0,1,0,0,0,0|1,1,0]=3 1049 B15R1.127 C=CCNC(=O)CSc1cccc(n1)Br 62a_100000183597_100000684672 [0,1,0,0,0,0|2,1,0]=4 1050 B15R1.127 C=CCNC(=O)CSc1cccc(n1)Br 62a_100000684672_100000183597 [0,1,0,0,0,0|2,1,0]=4 1051 B15R1.127 C=CCNC(=O)CSc1cccc(n1)C 62a_100000183597_100000742759 [0,1,0,0,0,0|2,1,0]=4 1052 B15R1.127 C=CCNC(=O)CSc1cccc(n1)C 62a_100000742759_100000183597 [0,1,0,0,0,0|2,1,0]=4 1053 B15R1.127 C=CCNC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000183597 [0,1,0,0,0,0|2,1,0]=4 1054 B15R1.127 C=CCNC(=O)CSc1cccc(n1)Cl 62a_100000183597_100000051397 [0,1,0,0,0,0|2,1,0]=4 1055 B15R1.127 C=CCNC(=O)CSc1cccc(n1)F 62a_100000183597_100009815982 [0,1,0,0,0,0|2,1,0]=4 1056 B15R1.127 C=CCNC(=O)CSc1cccc(n1)F 62a_100009815982_100000183597 [0,1,0,0,0,0|2,1,0]=4 1057 B15R1.127 C=CCNC(=O)CSc1cccc(n1)N 62a_100000183597_100000740741 [0,1,0,0,0,0|2,1,0]=4 1058 B15R1.127 C=CCNC(=O)CSc1cccc(n1)N 62a_100000740741_100000183597 [0,1,0,0,0,0|2,1,0]=4 1059 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)Br 62a_100000183597_100009814637 [0,1,0,0,0,0|2,1,0]=4 1060 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000183597 [0,1,0,0,0,0|2,1,0]=4 1061 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)C 62a_100000183597_100000758586 [0,1,0,0,0,0|2,1,0]=4 1062 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)C 62a_100000758586_100000183597 [0,1,0,0,0,0|2,1,0]=4 1063 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000183597 [0,1,0,0,0,0|2,1,0]=4 1064 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)Cl 62a_100000183597_100000035001 [0,1,0,0,0,0|2,1,0]=4 1065 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)F 62a_100000183597_100009816116 [0,1,0,0,0,0|2,1,0]=4 1066 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)F 62a_100009816116_100000183597 [0,1,0,0,0,0|2,1,0]=4 1067 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)N 62a_100000049665_100000183597 [0,1,0,0,0,0|2,1,0]=4 1068 B15R1.127 C=CCNC(=O)CSc1ccnc(c1)N 62a_100000183597_100000049665 [0,1,0,0,0,0|2,1,0]=4 1069 B15R1.127 C=CCNC(=O)CSc1cncc(c1)Br 62a_100000183597_100000728054 [0,1,0,0,0,0|2,1,0]=4 1070 B15R1.127 C=CCNC(=O)CSc1cncc(c1)Br 62a_100000728054_100000183597 [0,1,0,0,0,0|2,1,0]=4 1071 B15R1.127 C=CCNC(=O)CSc1cncc(c1)C 62a_100000183597_100000760492 [0,1,0,0,0,0|2,1,0]=4 1072 B15R1.127 C=CCNC(=O)CSc1cncc(c1)C 62a_100000760492_100000183597 [0,1,0,0,0,0|2,1,0]=4 1073 B15R1.127 C=CCNC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000183597 [0,1,0,0,0,0|2,1,0]=4 1074 B15R1.127 C=CCNC(=O)CSc1cncc(c1)Cl 62a_100000183597_100000049639 [0,1,0,0,0,0|2,1,0]=4 1075 B15R1.127 C=CCNC(=O)CSc1cncc(c1)F 62a_100000183597_100000744099 [0,1,0,0,0,0|2,1,0]=4 1076 B15R1.127 C=CCNC(=O)CSc1cncc(c1)F 62a_100000744099_100000183597 [0,1,0,0,0,0|2,1,0]=4 1077 B15R1.127 C=CCNC(=O)CSc1cncc(c1)N 62a_100000183597_100000687067 [0,1,0,0,0,0|2,1,0]=4 1078 B15R1.127 C=CCNC(=O)CSc1cncc(c1)N 62a_100000687067_100000183597 [0,1,0,0,0,0|2,1,0]=4 1079 B15R1.127 C=CCNC(=O)CSc1cncc(c1)O 62a_100000183597_100000754920 [0,1,0,0,0,0|2,1,0]=4 1080 B15R1.127 C=CCNC(=O)CSc1cncc(c1)O 62a_100000754920_100000183597 [0,1,0,0,0,0|2,1,0]=4 1081 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Br 2708a_100000174977_100020586998 [0,1,0,0,0,0|3,0,0]=4 1082 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100020586998 [0,1,0,0,0,0|3,0,0]=4 1083 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Br 273464a_100020586998_100000174977 [0,1,0,0,0,0|3,0,0]=4 1084 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Br 512a_100000174977_100020586998 [0,1,0,0,0,0|3,0,0]=4 1085 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Br 512a_100020586998_100000174977 [0,1,0,0,0,0|3,0,0]=4 1086 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C 2708a_100000185548_100020586998 [0,1,0,0,0,0|3,0,0]=4 1087 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C 273464a_100000185548_100020586998 [0,1,0,0,0,0|3,0,0]=4 1088 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C 273464a_100020586998_100000185548 [0,1,0,0,0,0|3,0,0]=4 1089 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C 512a_100000185548_100020586998 [0,1,0,0,0,0|3,0,0]=4 1090 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C 512a_100020586998_100000185548 [0,1,0,0,0,0|3,0,0]=4 1091 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_100020586998 [0,1,0,0,0,0|3,0,0]=4 1092 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100020586998 [0,1,0,0,0,0|3,0,0]=4 1093 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Cl 273464a_100020586998_100000174878 [0,1,0,0,0,0|3,0,0]=4 1094 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100020586998 [0,1,0,0,0,0|3,0,0]=4 1095 B15R1.127 C=CCNC(=O)NCc1cccc(c1)Cl 512a_100020586998_100000174878 [0,1,0,0,0,0|3,0,0]=4 1096 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F 2708a_100000174948_100020586998 [0,1,0,0,0,0|3,0,0]=4 1097 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F 273464a_100000174948_100020586998 [0,1,0,0,0,0|3,0,0]=4 1098 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F 273464a_100020586998_100000174948 [0,1,0,0,0,0|3,0,0]=4 1099 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F 512a_100000174948_100020586998 [0,1,0,0,0,0|3,0,0]=4 1100 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F 512a_100020586998_100000174948 [0,1,0,0,0,0|3,0,0]=4 1101 B15R1.127 C=CCNC(=O)NCc1cccc(c1)I 2708a_100000106179_100020586998 [0,1,0,0,0,0|3,0,0]=4 1102 B15R1.127 C=CCNC(=O)NCc1cccc(c1)I 273464a_100000106179_100020586998 [0,1,0,0,0,0|3,0,0]=4 1103 B15R1.127 C=CCNC(=O)NCc1cccc(c1)I 273464a_100020586998_100000106179 [0,1,0,0,0,0|3,0,0]=4 1104 B15R1.127 C=CCNC(=O)NCc1cccc(c1)I 512a_100000106179_100020586998 [0,1,0,0,0,0|3,0,0]=4 1105 B15R1.127 C=CCNC(=O)NCc1cccc(c1)I 512a_100020586998_100000106179 [0,1,0,0,0,0|3,0,0]=4 1106 B15R1.127 C=CCNC(=O)NCc1cccc(c1)O 2708a_100000743036_100020586998 [0,1,0,0,0,0|3,0,0]=4 1107 B15R1.127 C=CCNC(=O)NCc1cccc(c1)O 273464a_100000743036_100020586998 [0,1,0,0,0,0|3,0,0]=4 1108 B15R1.127 C=CCNC(=O)NCc1cccc(c1)O 273464a_100020586998_100000743036 [0,1,0,0,0,0|3,0,0]=4 1109 B15R1.127 C=CCNC(=O)NCc1cccc(c1)O 512a_100000743036_100020586998 [0,1,0,0,0,0|3,0,0]=4 1110 B15R1.127 C=CCNC(=O)NCc1cccc(c1)O 512a_100020586998_100000743036 [0,1,0,0,0,0|3,0,0]=4 1111 B15R1.127 C=CCNC(=O)NNc1cccc(c1)Br 273464a_100020586998_100000217339 [0,1,0,0,0,0|3,0,0]=4 1112 B15R1.127 C=CCNC(=O)NNc1cccc(c1)Br 512a_100000217339_100020586998 [0,1,0,0,0,0|3,0,0]=4 1113 B15R1.127 C=CCNC(=O)NNc1cccc(c1)Br 512a_100020586998_100000217339 [0,1,0,0,0,0|3,0,0]=4 1114 B15R1.127 C=CCNC(=O)NNc1cccc(c1)C 273464a_100020586998_100000681630 [0,1,0,0,0,0|3,0,0]=4 1115 B15R1.127 C=CCNC(=O)NNc1cccc(c1)C 512a_100000681630_100020586998 [0,1,0,0,0,0|3,0,0]=4 1116 B15R1.127 C=CCNC(=O)NNc1cccc(c1)C 512a_100020586998_100000681630 [0,1,0,0,0,0|3,0,0]=4 1117 B15R1.127 C=CCNC(=O)NNc1cccc(c1)Cl 273464a_100020586998_100000184277 [0,1,0,0,0,0|3,0,0]=4 1118 B15R1.127 C=CCNC(=O)NNc1cccc(c1)Cl 512a_100020586998_100000184277 [0,1,0,0,0,0|3,0,0]=4 1119 B15R1.127 C=CCNC(=O)NNc1cccc(c1)F 273464a_100020586998_100000745080 [0,1,0,0,0,0|3,0,0]=4 1120 B15R1.127 C=CCNC(=O)NNc1cccc(c1)F 512a_100000745080_100020586998 [0,1,0,0,0,0|3,0,0]=4 1121 B15R1.127 C=CCNC(=O)NNc1cccc(c1)F 512a_100020586998_100000745080 [0,1,0,0,0,0|3,0,0]=4 1122 B15R1.127 C=CCNC(=O)NNc1cccc(c1)I 273464a_100020586998_100020605690 [0,1,0,0,0,0|3,0,0]=4 1123 B15R1.127 C=CCNC(=O)NNc1cccc(c1)I 512a_100020586998_100020605690 [0,1,0,0,0,0|3,0,0]=4 1124 B15R1.127 C=CCNC(=O)NNc1cccc(c1)I 512a_100020605690_100020586998 [0,1,0,0,0,0|3,0,0]=4 1125 B15R1.127 C=CCOC(=O)CNc1cccc(c1)Br 34a_100000210019_100000033060 [0,1,0,0,0,0|1,0,0]=2 1126 B15R1.127 C=CCOC(=O)CNc1cccc(c1)C 2230a_100000188690_100000033060 [0,1,0,0,0,0|1,0,0]=2 1127 B15R1.127 C=CCOC(=O)CNc1cccc(c1)C 34a_100000188690_100000033060 [0,1,0,0,0,0|1,0,0]=2 1128 B15R1.127 C=CCOC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000033060 [0,1,0,0,0,0|1,0,0]=2 1129 B15R1.127 C=CCOC(=O)CNc1cccc(c1)F 34a_100000210047_100000033060 [0,1,0,0,0,0|1,0,0]=2 1130 B15R1.127 C=CCOC(=O)CNc1cccc(c1)I 34a_100000211102_100000033060 [0,1,0,0,0,0|1,0,0]=2 1131 B15R1.127 C=CCOC(=O)CNc1cccc(c1)O 34a_100000210217_100000033060 [0,1,0,0,0,0|1,0,0]=2 1132 B15R1.127 C=CCOC(=O)COc1cc(cnn1)C 34a_100000766097_100000033060 [0,1,0,0,0,0|2,0,0]=3 1133 B15R1.127 C=CCOC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000033060 [0,1,0,0,0,0|1,0,0]=2 1134 B15R1.127 C=CCOC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000033060 [0,1,0,0,0,0|1,0,0]=2 1135 B15R1.127 C=CCOC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000033060 [0,1,0,0,0,0|1,0,0]=2 1136 B15R1.127 C=CCOC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000033060 [0,1,0,0,0,0|1,0,0]=2 1137 B15R1.127 C=CCOC(=O)COc1cccc(c1)Br 34a_100000210342_100000033060 [0,1,0,0,0,0|0,0,0]=1 1138 B15R1.127 C=CCOC(=O)COc1cccc(c1)Br 7a_100000210342_100000033060 [0,1,0,0,0,0|0,0,0]=1 1139 B15R1.127 C=CCOC(=O)COc1cccc(c1)C 34a_100000210337_100000033060 [0,1,0,0,0,0|0,0,0]=1 1140 B15R1.127 C=CCOC(=O)COc1cccc(c1)C 7a_100000210337_100000033060 [0,1,0,0,0,0|0,0,0]=1 1141 B15R1.127 C=CCOC(=O)COc1cccc(c1)Cl 34a_100000210295_100000033060 [0,1,0,0,0,0|0,0,0]=1 1142 B15R1.127 C=CCOC(=O)COc1cccc(c1)Cl 7a_100000210295_100000033060 [0,1,0,0,0,0|0,0,0]=1 1143 B15R1.127 C=CCOC(=O)COc1cccc(c1)F 34a_100000210426_100000033060 [0,1,0,0,0,0|0,0,0]=1 1144 B15R1.127 C=CCOC(=O)COc1cccc(c1)F 7a_100000210426_100000033060 [0,1,0,0,0,0|0,0,0]=1 1145 B15R1.127 C=CCOC(=O)COc1cccc(c1)I 34a_100000211634_100000033060 [0,1,0,0,0,0|0,0,0]=1 1146 B15R1.127 C=CCOC(=O)COc1cccc(c1)I 7a_100000211634_100000033060 [0,1,0,0,0,0|0,0,0]=1 1147 B15R1.127 C=CCOC(=O)COc1cccc(c1)N 34a_100000210217_100000033060 [0,1,0,0,0,0|0,0,0]=1 1148 B15R1.127 C=CCOC(=O)COc1cccc(n1)F 34a_100011432558_100000033060 [0,1,0,0,0,0|1,0,0]=2 1149 B15R1.127 C=CCOC(=O)COc1ccnc(c1)C 34a_100000688365_100000033060 [0,1,0,0,0,0|1,0,0]=2 1150 B15R1.127 C=CCOC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000033060 [0,1,0,0,0,0|1,0,0]=2 1151 B15R1.127 C=CCOC(=O)COc1ccnc(c1)F 34a_100000732698_100000033060 [0,1,0,0,0,0|1,0,0]=2 1152 B15R1.127 C=CCOC(=O)COc1ccnc(c1)N 34a_100011834064_100000033060 [0,1,0,0,0,0|1,0,0]=2 1153 B15R1.127 C=CCOC(=O)COc1cncc(c1)Br 34a_100000754920_100000033060 [0,1,0,0,0,0|1,0,0]=2 1154 B15R1.127 C=CCOC(=O)COc1cncc(c1)Br 7a_100000754920_100000033060 [0,1,0,0,0,0|1,0,0]=2 1155 B15R1.127 C=CCOC(=O)COc1cncc(c1)C 34a_100011830280_100000033060 [0,1,0,0,0,0|1,0,0]=2 1156 B15R1.127 C=CCOC(=O)COc1cncc(c1)C 7a_100011830280_100000033060 [0,1,0,0,0,0|1,0,0]=2 1157 B15R1.127 C=CCOC(=O)COc1cncc(c1)Cl 7a_100000032511_100000033060 [0,1,0,0,0,0|1,0,0]=2 1158 B15R1.127 C=CCOC(=O)COc1cncc(c1)F 34a_100011830296_100000033060 [0,1,0,0,0,0|1,0,0]=2 1159 B15R1.127 C=CCOC(=O)COc1cncc(c1)F 7a_100011830296_100000033060 [0,1,0,0,0,0|1,0,0]=2 1160 B15R1.127 C=CCOC(=O)COc1cncc(c1)N 34a_100011997051_100000033060 [0,1,0,0,0,0|1,0,0]=2 1161 B15R1.127 C=CCOC(=O)COc1cnnc(c1)Cl 34a_200010734679_100000033060 [0,1,0,0,0,0|2,0,0]=3 1162 B15R1.127 C=CCOC(=O)COc1cnnc(c1)N 34a_200015193112_100000033060 [0,1,0,0,0,0|2,0,0]=3 1163 B15R1.127 C=CCOC(=O)CSc1c[n+](ccn1)[O-] 62a_100000033060_100009880115 [0,1,0,0,0,0|2,1,0]=4 1164 B15R1.127 C=CCOC(=O)CSc1cc(=O)[nH]cn1 62a_100012002517_100000033060 [0,1,0,0,0,0|2,1,0]=4 1165 B15R1.127 C=CCOC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000033060 [0,1,0,0,0,0|1,1,0]=3 1166 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)C 62a_100000033060_100000750283 [0,1,0,0,0,0|1,1,0]=3 1167 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)C 62a_100000750283_100000033060 [0,1,0,0,0,0|1,1,0]=3 1168 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)Cl 62a_100000033060_100010167805 [0,1,0,0,0,0|1,1,0]=3 1169 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000033060 [0,1,0,0,0,0|1,1,0]=3 1170 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)F 62a_100000033060_100000764206 [0,1,0,0,0,0|1,1,0]=3 1171 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)F 62a_100000764206_100000033060 [0,1,0,0,0,0|1,1,0]=3 1172 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)N 62a_100000033060_100009814236 [0,1,0,0,0,0|1,1,0]=3 1173 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)N 62a_100009814236_100000033060 [0,1,0,0,0,0|1,1,0]=3 1174 B15R1.127 C=CCOC(=O)CSc1cc(ccn1)O 62a_100000033060_100000762945 [0,1,0,0,0,0|1,1,0]=3 1175 B15R1.127 C=CCOC(=O)CSc1cc(cnn1)C 62a_100000033060_100000070100 [0,1,0,0,0,0|2,1,0]=4 1176 B15R1.127 C=CCOC(=O)CSc1cc(cnn1)C 62a_100000070100_100000033060 [0,1,0,0,0,0|2,1,0]=4 1177 B15R1.127 C=CCOC(=O)CSc1cc(cnn1)N 62a_100000033060_100011996757 [0,1,0,0,0,0|2,1,0]=4 1178 B15R1.127 C=CCOC(=O)CSc1cc(cnn1)N 62a_100011996757_100000033060 [0,1,0,0,0,0|2,1,0]=4 1179 B15R1.127 C=CCOC(=O)CSc1cc(cnn1)O 62a_100000033060_200010734679 [0,1,0,0,0,0|2,1,0]=4 1180 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)C 62a_100000033060_100000744208 [0,1,0,0,0,0|2,1,0]=4 1181 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)C 62a_100000744208_100000033060 [0,1,0,0,0,0|2,1,0]=4 1182 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)Cl 62a_100000033060_100010161198 [0,1,0,0,0,0|2,1,0]=4 1183 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)Cl 62a_100010161198_100000033060 [0,1,0,0,0,0|2,1,0]=4 1184 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)F 62a_100000033060_200009880791 [0,1,0,0,0,0|2,1,0]=4 1185 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)F 62a_200009880791_100000033060 [0,1,0,0,0,0|2,1,0]=4 1186 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)N 62a_100000033060_100000701291 [0,1,0,0,0,0|2,1,0]=4 1187 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)N 62a_100000701291_100000033060 [0,1,0,0,0,0|2,1,0]=4 1188 B15R1.127 C=CCOC(=O)CSc1cc(ncn1)O 62a_100000033060_100000765262 [0,1,0,0,0,0|2,1,0]=4 1189 B15R1.127 C=CCOC(=O)CSc1cc[nH]c(=O)c1 62a_100000033060_100009816521 [0,1,0,0,0,0|1,1,0]=3 1190 B15R1.127 C=CCOC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000033060 [0,1,0,0,0,0|1,1,0]=3 1191 B15R1.127 C=CCOC(=O)CSc1cc[nH]c(=O)n1 62a_100000033060_200000134032 [0,1,0,0,0,0|2,1,0]=4 1192 B15R1.127 C=CCOC(=O)CSc1ccc[n+](c1)C 62a_100000033060_100009996589 [0,1,0,0,0,0|1,1,0]=3 1193 B15R1.127 C=CCOC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000033060 [0,1,0,0,0,0|1,1,0]=3 1194 B15R1.127 C=CCOC(=O)CSc1ccc[n+](c1)[O-] 62a_100000033060_100009815978 [0,1,0,0,0,0|1,1,0]=3 1195 B15R1.127 C=CCOC(=O)CSc1cccc(=O)[nH]1 62a_100000033060_100000752884 [0,1,0,0,0,0|1,1,0]=3 1196 B15R1.127 C=CCOC(=O)CSc1cccc(c1)Br 62a_100000033060_100000691529 [0,1,0,0,0,0|0,1,0]=2 1197 B15R1.127 C=CCOC(=O)CSc1cccc(c1)Br 62a_100000691529_100000033060 [0,1,0,0,0,0|0,1,0]=2 1198 B15R1.127 C=CCOC(=O)CSc1cccc(c1)C 62a_100000033060_100011215228 [0,1,0,0,0,0|0,1,0]=2 1199 B15R1.127 C=CCOC(=O)CSc1cccc(c1)C 62a_100011215228_100000033060 [0,1,0,0,0,0|0,1,0]=2 1200 B15R1.127 C=CCOC(=O)CSc1cccc(c1)Cl 62a_100000033060_100000699651 [0,1,0,0,0,0|0,1,0]=2 1201 B15R1.127 C=CCOC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000033060 [0,1,0,0,0,0|0,1,0]=2 1202 B15R1.127 C=CCOC(=O)CSc1cccc(c1)F 62a_100000033060_100000685547 [0,1,0,0,0,0|0,1,0]=2 1203 B15R1.127 C=CCOC(=O)CSc1cccc(c1)F 62a_100000685547_100000033060 [0,1,0,0,0,0|0,1,0]=2 1204 B15R1.127 C=CCOC(=O)CSc1cccc(c1)N 62a_100000033060_100000210019 [0,1,0,0,0,0|0,1,0]=2 1205 B15R1.127 C=CCOC(=O)CSc1cccc(c1)N 62a_100000210019_100000033060 [0,1,0,0,0,0|0,1,0]=2 1206 B15R1.127 C=CCOC(=O)CSc1cccc(c1)O 62a_100000033060_100000211634 [0,1,0,0,0,0|0,1,0]=2 1207 B15R1.127 C=CCOC(=O)CSc1cccc(c1)[S] 62a_100000033060_114929384022 [0,1,0,0,0,0|0,1,0]=2 1208 B15R1.127 C=CCOC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000033060 [0,1,0,0,0,0|0,1,0]=2 1209 B15R1.127 C=CCOC(=O)CSc1cccc(n1)Br 62a_100000033060_100000684672 [0,1,0,0,0,0|1,1,0]=3 1210 B15R1.127 C=CCOC(=O)CSc1cccc(n1)Br 62a_100000684672_100000033060 [0,1,0,0,0,0|1,1,0]=3 1211 B15R1.127 C=CCOC(=O)CSc1cccc(n1)C 62a_100000033060_100000742759 [0,1,0,0,0,0|1,1,0]=3 1212 B15R1.127 C=CCOC(=O)CSc1cccc(n1)C 62a_100000742759_100000033060 [0,1,0,0,0,0|1,1,0]=3 1213 B15R1.127 C=CCOC(=O)CSc1cccc(n1)Cl 62a_100000033060_100000051397 [0,1,0,0,0,0|1,1,0]=3 1214 B15R1.127 C=CCOC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000033060 [0,1,0,0,0,0|1,1,0]=3 1215 B15R1.127 C=CCOC(=O)CSc1cccc(n1)F 62a_100000033060_100009815982 [0,1,0,0,0,0|1,1,0]=3 1216 B15R1.127 C=CCOC(=O)CSc1cccc(n1)F 62a_100009815982_100000033060 [0,1,0,0,0,0|1,1,0]=3 1217 B15R1.127 C=CCOC(=O)CSc1cccc(n1)N 62a_100000033060_100000740741 [0,1,0,0,0,0|1,1,0]=3 1218 B15R1.127 C=CCOC(=O)CSc1cccc(n1)N 62a_100000740741_100000033060 [0,1,0,0,0,0|1,1,0]=3 1219 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)Br 62a_100000033060_100009814637 [0,1,0,0,0,0|1,1,0]=3 1220 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000033060 [0,1,0,0,0,0|1,1,0]=3 1221 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)C 62a_100000033060_100000758586 [0,1,0,0,0,0|1,1,0]=3 1222 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)C 62a_100000758586_100000033060 [0,1,0,0,0,0|1,1,0]=3 1223 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)Cl 62a_100000033060_100000035001 [0,1,0,0,0,0|1,1,0]=3 1224 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000033060 [0,1,0,0,0,0|1,1,0]=3 1225 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)F 62a_100000033060_100009816116 [0,1,0,0,0,0|1,1,0]=3 1226 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)F 62a_100009816116_100000033060 [0,1,0,0,0,0|1,1,0]=3 1227 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)N 62a_100000033060_100000049665 [0,1,0,0,0,0|1,1,0]=3 1228 B15R1.127 C=CCOC(=O)CSc1ccnc(c1)N 62a_100000049665_100000033060 [0,1,0,0,0,0|1,1,0]=3 1229 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)C 62a_100000033060_100000749937 [0,1,0,0,0,0|2,1,0]=4 1230 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)C 62a_100000749937_100000033060 [0,1,0,0,0,0|2,1,0]=4 1231 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)Cl 62a_100000033060_100010154678 [0,1,0,0,0,0|2,1,0]=4 1232 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)Cl 62a_100010154678_100000033060 [0,1,0,0,0,0|2,1,0]=4 1233 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)N 62a_100000033060_100000055538 [0,1,0,0,0,0|2,1,0]=4 1234 B15R1.127 C=CCOC(=O)CSc1ccnc(n1)N 62a_100000055538_100000033060 [0,1,0,0,0,0|2,1,0]=4 1235 B15R1.127 C=CCOC(=O)CSc1cn[nH]c(=O)c1 62a_100000033060_100010197405 [0,1,0,0,0,0|2,1,0]=4 1236 B15R1.127 C=CCOC(=O)CSc1cncc(c1)Br 62a_100000033060_100000728054 [0,1,0,0,0,0|1,1,0]=3 1237 B15R1.127 C=CCOC(=O)CSc1cncc(c1)Br 62a_100000728054_100000033060 [0,1,0,0,0,0|1,1,0]=3 1238 B15R1.127 C=CCOC(=O)CSc1cncc(c1)C 62a_100000033060_100000760492 [0,1,0,0,0,0|1,1,0]=3 1239 B15R1.127 C=CCOC(=O)CSc1cncc(c1)C 62a_100000760492_100000033060 [0,1,0,0,0,0|1,1,0]=3 1240 B15R1.127 C=CCOC(=O)CSc1cncc(c1)Cl 62a_100000033060_100000049639 [0,1,0,0,0,0|1,1,0]=3 1241 B15R1.127 C=CCOC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000033060 [0,1,0,0,0,0|1,1,0]=3 1242 B15R1.127 C=CCOC(=O)CSc1cncc(c1)F 62a_100000033060_100000744099 [0,1,0,0,0,0|1,1,0]=3 1243 B15R1.127 C=CCOC(=O)CSc1cncc(c1)F 62a_100000744099_100000033060 [0,1,0,0,0,0|1,1,0]=3 1244 B15R1.127 C=CCOC(=O)CSc1cncc(c1)N 62a_100000033060_100000687067 [0,1,0,0,0,0|1,1,0]=3 1245 B15R1.127 C=CCOC(=O)CSc1cncc(c1)N 62a_100000687067_100000033060 [0,1,0,0,0,0|1,1,0]=3 1246 B15R1.127 C=CCOC(=O)CSc1cncc(c1)O 62a_100000033060_100000754920 [0,1,0,0,0,0|1,1,0]=3 1247 B15R1.127 C=CCOC(=O)CSc1cncc(c1)O 62a_100000754920_100000033060 [0,1,0,0,0,0|1,1,0]=3 1248 B15R1.127 C=CCOC(=O)CSc1cncc(n1)C 62a_100000033060_100000754123 [0,1,0,0,0,0|2,1,0]=4 1249 B15R1.127 C=CCOC(=O)CSc1cncc(n1)C 62a_100000754123_100000033060 [0,1,0,0,0,0|2,1,0]=4 1250 B15R1.127 C=CCOC(=O)CSc1cncc(n1)Cl 62a_100000033060_100010892449 [0,1,0,0,0,0|2,1,0]=4 1251 B15R1.127 C=CCOC(=O)CSc1cncc(n1)Cl 62a_100010892449_100000033060 [0,1,0,0,0,0|2,1,0]=4 1252 B15R1.127 C=CCOC(=O)CSc1cncc(n1)F 62a_100000033060_200009863489 [0,1,0,0,0,0|2,1,0]=4 1253 B15R1.127 C=CCOC(=O)CSc1cncc(n1)F 62a_200009863489_100000033060 [0,1,0,0,0,0|2,1,0]=4 1254 B15R1.127 C=CCOC(=O)CSc1cncc(n1)N 62a_100000033060_100000747728 [0,1,0,0,0,0|2,1,0]=4 1255 B15R1.127 C=CCOC(=O)CSc1cncc(n1)N 62a_100000747728_100000033060 [0,1,0,0,0,0|2,1,0]=4 1256 B15R1.127 C=CCOC(=O)CSc1cncc(n1)O 62a_100000033060_100011269956 [0,1,0,0,0,0|2,1,0]=4 1257 B15R1.127 C=CCOC(=O)CSc1cnnc(c1)N 62a_100000033060_100000130277 [0,1,0,0,0,0|2,1,0]=4 1258 B15R1.127 C=CCOC(=O)CSc1cnnc(c1)N 62a_100000130277_100000033060 [0,1,0,0,0,0|2,1,0]=4 1259 B15R1.127 C=CCOC(=O)CSc1nccc(n1)C 62a_100000033060_100011243806 [0,1,0,0,0,0|2,1,0]=4 1260 B15R1.127 C=CCOC(=O)CSc1nccc(n1)C 62a_100011243806_100000033060 [0,1,0,0,0,0|2,1,0]=4 1261 B15R1.127 C=CCOC(=O)CSc1nccc(n1)N 62a_100000033060_100000757536 [0,1,0,0,0,0|2,1,0]=4 1262 B15R1.127 C=CCOC(=O)CSc1nccc(n1)N 62a_100000757536_100000033060 [0,1,0,0,0,0|2,1,0]=4 1263 B15R1.127 C=CCOC(=O)CSc1nccc(n1)O 62a_100000033060_100011649813 [0,1,0,0,0,0|2,1,0]=4 1264 B15R1.127 C=CCOC(C)COc1cccc(c1)C 34a_200011219432_100015514636 [0,1,0,0,0,0|1,0,1]=3 1265 B15R1.127 C=CCOC(C)COc1cccc(c1)C 7a_200011219432_100015514636 [0,1,0,0,0,0|1,0,1]=3 1266 B15R1.127 CC=CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000070051 [0,1,0,0,0,0|1,0,2]=4 1267 B15R1.127 CC=CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000070051 [0,1,0,0,0,0|1,0,2]=4 1268 B15R1.127 CC=CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000070051 [0,1,0,0,0,0|1,0,2]=4 1269 B15R1.127 CC=CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000070051 [0,1,0,0,0,0|1,0,2]=4 1270 B15R1.127 CC=NNC(=O)COc1cccc(c1)Br 4a_100000184228_200000210099 [0,1,0,0,0,0|2,0,1]=4 1271 B15R1.127 CC=NNC(=O)COc1cccc(c1)C 4a_100000182877_200000210099 [0,1,0,0,0,0|2,0,1]=4 1272 B15R1.127 CC=NNC(=O)COc1cccc(c1)F 4a_100000182990_200000210099 [0,1,0,0,0,0|2,0,1]=4 1273 B15R1.127 CCCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210211 [0,1,0,0,0,0|1,0,2]=4 1274 B15R1.127 CCCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210211 [0,1,0,0,0,0|1,0,2]=4 1275 B15R1.127 CCCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210211 [0,1,0,0,0,0|1,0,2]=4 1276 B15R1.127 CCCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210211 [0,1,0,0,0,0|1,0,2]=4 1277 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 11a_100020643023_100000182359 [0,1,0,0,0,0|1,0,2]=4 1278 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 1626a_100020643023_100000182359 [0,1,0,0,0,0|1,0,2]=4 1279 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 240690a_100020643023_100000182359 [0,1,0,0,0,0|1,0,2]=4 1280 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183358 [0,1,0,0,0,0|1,0,2]=4 1281 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 527a_100020643023_100000182359 [0,1,0,0,0,0|1,0,2]=4 1282 B15R1.127 CCCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183358 [0,1,0,0,0,0|1,0,2]=4 1283 B15R1.127 CCCNC(=O)COc1cccc(c1)C 11a_100020643023_100000183606 [0,1,0,0,0,0|1,0,2]=4 1284 B15R1.127 CCCNC(=O)COc1cccc(c1)C 1626a_100020643023_100000183606 [0,1,0,0,0,0|1,0,2]=4 1285 B15R1.127 CCCNC(=O)COc1cccc(c1)C 240690a_100020643023_100000183606 [0,1,0,0,0,0|1,0,2]=4 1286 B15R1.127 CCCNC(=O)COc1cccc(c1)C 34a_100000210337_100000183358 [0,1,0,0,0,0|1,0,2]=4 1287 B15R1.127 CCCNC(=O)COc1cccc(c1)C 527a_100020643023_100000183606 [0,1,0,0,0,0|1,0,2]=4 1288 B15R1.127 CCCNC(=O)COc1cccc(c1)C 7a_100000210337_100000183358 [0,1,0,0,0,0|1,0,2]=4 1289 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 11a_100020643023_100000184978 [0,1,0,0,0,0|1,0,2]=4 1290 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 1626a_100020643023_100000184978 [0,1,0,0,0,0|1,0,2]=4 1291 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 240690a_100020643023_100000184978 [0,1,0,0,0,0|1,0,2]=4 1292 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183358 [0,1,0,0,0,0|1,0,2]=4 1293 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 527a_100020643023_100000184978 [0,1,0,0,0,0|1,0,2]=4 1294 B15R1.127 CCCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183358 [0,1,0,0,0,0|1,0,2]=4 1295 B15R1.127 CCCNC(=O)COc1cccc(c1)F 11a_100020643023_100000182781 [0,1,0,0,0,0|1,0,2]=4 1296 B15R1.127 CCCNC(=O)COc1cccc(c1)F 1626a_100020643023_100000182781 [0,1,0,0,0,0|1,0,2]=4 1297 B15R1.127 CCCNC(=O)COc1cccc(c1)F 240690a_100020643023_100000182781 [0,1,0,0,0,0|1,0,2]=4 1298 B15R1.127 CCCNC(=O)COc1cccc(c1)F 34a_100000210426_100000183358 [0,1,0,0,0,0|1,0,2]=4 1299 B15R1.127 CCCNC(=O)COc1cccc(c1)F 527a_100020643023_100000182781 [0,1,0,0,0,0|1,0,2]=4 1300 B15R1.127 CCCNC(=O)COc1cccc(c1)F 7a_100000210426_100000183358 [0,1,0,0,0,0|1,0,2]=4 1301 B15R1.127 CCCNC(=O)COc1cccc(c1)I 34a_100000211634_100000183358 [0,1,0,0,0,0|1,0,2]=4 1302 B15R1.127 CCCNC(=O)COc1cccc(c1)I 7a_100000211634_100000183358 [0,1,0,0,0,0|1,0,2]=4 1303 B15R1.127 CCCNC(=O)COc1cccc(c1)N 34a_100000210217_100000183358 [0,1,0,0,0,0|1,0,2]=4 1304 B15R1.127 CCCOC(=O)CNc1cccc(c1)Br 34a_100000210019_200011215008 [0,1,0,0,0,0|1,0,2]=4 1305 B15R1.127 CCCOC(=O)CNc1cccc(c1)C 2230a_100000188690_200011215008 [0,1,0,0,0,0|1,0,2]=4 1306 B15R1.127 CCCOC(=O)CNc1cccc(c1)C 34a_100000188690_200011215008 [0,1,0,0,0,0|1,0,2]=4 1307 B15R1.127 CCCOC(=O)CNc1cccc(c1)Cl 34a_100000185859_200011215008 [0,1,0,0,0,0|1,0,2]=4 1308 B15R1.127 CCCOC(=O)CNc1cccc(c1)F 34a_100000210047_200011215008 [0,1,0,0,0,0|1,0,2]=4 1309 B15R1.127 CCCOC(=O)CNc1cccc(c1)I 34a_100000211102_200011215008 [0,1,0,0,0,0|1,0,2]=4 1310 B15R1.127 CCCOC(=O)CNc1cccc(c1)O 34a_100000210217_200011215008 [0,1,0,0,0,0|1,0,2]=4 1311 B15R1.127 CCCOC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_200011215008 [0,1,0,0,0,0|1,0,2]=4 1312 B15R1.127 CCCOC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_200011215008 [0,1,0,0,0,0|1,0,2]=4 1313 B15R1.127 CCCOC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_200011215008 [0,1,0,0,0,0|1,0,2]=4 1314 B15R1.127 CCCOC(=O)COc1cccc(=O)[nH]1 34a_100000033347_200011215008 [0,1,0,0,0,0|1,0,2]=4 1315 B15R1.127 CCCOC(=O)COc1cccc(c1)Br 34a_100000210342_200011215008 [0,1,0,0,0,0|0,0,2]=3 1316 B15R1.127 CCCOC(=O)COc1cccc(c1)Br 7a_100000210342_200011215008 [0,1,0,0,0,0|0,0,2]=3 1317 B15R1.127 CCCOC(=O)COc1cccc(c1)C 34a_100000210337_200011215008 [0,1,0,0,0,0|0,0,2]=3 1318 B15R1.127 CCCOC(=O)COc1cccc(c1)C 7a_100000210337_200011215008 [0,1,0,0,0,0|0,0,2]=3 1319 B15R1.127 CCCOC(=O)COc1cccc(c1)Cl 34a_100000210295_200011215008 [0,1,0,0,0,0|0,0,2]=3 1320 B15R1.127 CCCOC(=O)COc1cccc(c1)Cl 7a_100000210295_200011215008 [0,1,0,0,0,0|0,0,2]=3 1321 B15R1.127 CCCOC(=O)COc1cccc(c1)F 34a_100000210426_200011215008 [0,1,0,0,0,0|0,0,2]=3 1322 B15R1.127 CCCOC(=O)COc1cccc(c1)F 7a_100000210426_200011215008 [0,1,0,0,0,0|0,0,2]=3 1323 B15R1.127 CCCOC(=O)COc1cccc(c1)I 34a_100000211634_200011215008 [0,1,0,0,0,0|0,0,2]=3 1324 B15R1.127 CCCOC(=O)COc1cccc(c1)I 7a_100000211634_200011215008 [0,1,0,0,0,0|0,0,2]=3 1325 B15R1.127 CCCOC(=O)COc1cccc(c1)N 34a_100000210217_200011215008 [0,1,0,0,0,0|0,0,2]=3 1326 B15R1.127 CCCOC(=O)COc1cccc(n1)F 34a_100011432558_200011215008 [0,1,0,0,0,0|1,0,2]=4 1327 B15R1.127 CCCOC(=O)COc1ccnc(c1)C 34a_100000688365_200011215008 [0,1,0,0,0,0|1,0,2]=4 1328 B15R1.127 CCCOC(=O)COc1ccnc(c1)Cl 34a_100000762945_200011215008 [0,1,0,0,0,0|1,0,2]=4 1329 B15R1.127 CCCOC(=O)COc1ccnc(c1)F 34a_100000732698_200011215008 [0,1,0,0,0,0|1,0,2]=4 1330 B15R1.127 CCCOC(=O)COc1ccnc(c1)N 34a_100011834064_200011215008 [0,1,0,0,0,0|1,0,2]=4 1331 B15R1.127 CCCOC(=O)COc1cncc(c1)Br 34a_100000754920_200011215008 [0,1,0,0,0,0|1,0,2]=4 1332 B15R1.127 CCCOC(=O)COc1cncc(c1)Br 7a_100000754920_200011215008 [0,1,0,0,0,0|1,0,2]=4 1333 B15R1.127 CCCOC(=O)COc1cncc(c1)C 34a_100011830280_200011215008 [0,1,0,0,0,0|1,0,2]=4 1334 B15R1.127 CCCOC(=O)COc1cncc(c1)C 7a_100011830280_200011215008 [0,1,0,0,0,0|1,0,2]=4 1335 B15R1.127 CCCOC(=O)COc1cncc(c1)Cl 7a_100000032511_200011215008 [0,1,0,0,0,0|1,0,2]=4 1336 B15R1.127 CCCOC(=O)COc1cncc(c1)F 34a_100011830296_200011215008 [0,1,0,0,0,0|1,0,2]=4 1337 B15R1.127 CCCOC(=O)COc1cncc(c1)F 7a_100011830296_200011215008 [0,1,0,0,0,0|1,0,2]=4 1338 B15R1.127 CCCOC(=O)COc1cncc(c1)N 34a_100011997051_200011215008 [0,1,0,0,0,0|1,0,2]=4 1339 B15R1.127 CCCOC(=O)CSc1cccc(c1)Br 62a_100000691529_200011215008 [0,1,0,0,0,0|0,1,2]=4 1340 B15R1.127 CCCOC(=O)CSc1cccc(c1)Br 62a_200011215008_100000691529 [0,1,0,0,0,0|0,1,2]=4 1341 B15R1.127 CCCOC(=O)CSc1cccc(c1)C 62a_100011215228_200011215008 [0,1,0,0,0,0|0,1,2]=4 1342 B15R1.127 CCCOC(=O)CSc1cccc(c1)C 62a_200011215008_100011215228 [0,1,0,0,0,0|0,1,2]=4 1343 B15R1.127 CCCOC(=O)CSc1cccc(c1)Cl 62a_100000699651_200011215008 [0,1,0,0,0,0|0,1,2]=4 1344 B15R1.127 CCCOC(=O)CSc1cccc(c1)Cl 62a_200011215008_100000699651 [0,1,0,0,0,0|0,1,2]=4 1345 B15R1.127 CCCOC(=O)CSc1cccc(c1)F 62a_100000685547_200011215008 [0,1,0,0,0,0|0,1,2]=4 1346 B15R1.127 CCCOC(=O)CSc1cccc(c1)F 62a_200011215008_100000685547 [0,1,0,0,0,0|0,1,2]=4 1347 B15R1.127 CCCOC(=O)CSc1cccc(c1)N 62a_100000210019_200011215008 [0,1,0,0,0,0|0,1,2]=4 1348 B15R1.127 CCCOC(=O)CSc1cccc(c1)N 62a_200011215008_100000210019 [0,1,0,0,0,0|0,1,2]=4 1349 B15R1.127 CCCOC(=O)CSc1cccc(c1)O 62a_200011215008_100000211634 [0,1,0,0,0,0|0,1,2]=4 1350 B15R1.127 CCCOC(=O)CSc1cccc(c1)[S] 62a_114929384022_200011215008 [0,1,0,0,0,0|0,1,2]=4 1351 B15R1.127 CCCOC(=O)CSc1cccc(c1)[S] 62a_200011215008_114929384022 [0,1,0,0,0,0|0,1,2]=4 1352 B15R1.127 COCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000233755 [0,1,0,0,0,0|2,0,1]=4 1353 B15R1.127 COCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000233755 [0,1,0,0,0,0|2,0,1]=4 1354 B15R1.127 COCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000233755 [0,1,0,0,0,0|2,0,1]=4 1355 B15R1.127 COCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000233755 [0,1,0,0,0,0|2,0,1]=4 1356 B15R1.127 CSCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000751147 [0,1,0,0,0,0|2,0,1]=4 1357 B15R1.127 CSCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000751147 [0,1,0,0,0,0|2,0,1]=4 1358 B15R1.127 CSCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000751147 [0,1,0,0,0,0|2,0,1]=4 1359 B15R1.127 CSCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000751147 [0,1,0,0,0,0|2,0,1]=4 1360 B15R1.127 Cc1cccc(c1)OCC(=O)CCC#N 1458a_100000183606_100011215226 [0,1,0,0,0,0|2,0,1]=4 1361 B15R1.127 Cc1cccc(c1)OCC(=O)CCCF 1458a_100000183606_100011934791 [0,1,0,0,0,0|2,0,1]=4 1362 B15R1.127 Cc1cccc(c1)OCC(=O)CCCO 1458a_100000183606_100011215043 [0,1,0,0,0,0|2,0,1]=4 1363 B15R1.127 Cc1cccc(c1)OCC(=O)NCC#N 1626a_100000734998_100000183606 [0,1,0,0,0,0|2,0,1]=4 1364 B15R1.127 Cc1cccc(c1)OCC(=O)NCC#N 527a_100000734998_100000183606 [0,1,0,0,0,0|2,0,1]=4 1365 B15R1.127 Cc1cccc(c1)OCC(=O)NCC#N 7a_100000210337_100000736037 [0,1,0,0,0,0|2,0,1]=4 1366 B15R1.127 Cc1cccc(c1)OCC(=O)NCCF 11a_100000724931_100000183606 [0,1,0,0,0,0|2,0,1]=4 1367 B15R1.127 Cc1cccc(c1)OCC(=O)NCCF 1626a_100000724931_100000183606 [0,1,0,0,0,0|2,0,1]=4 1368 B15R1.127 Cc1cccc(c1)OCC(=O)NCCF 240690a_100000724931_100000183606 [0,1,0,0,0,0|2,0,1]=4 1369 B15R1.127 Cc1cccc(c1)OCC(=O)NCCF 527a_100000724931_100000183606 [0,1,0,0,0,0|2,0,1]=4 1370 B15R1.127 Cc1cccc(c1)OCC(=O)NCCO 240690a_100000210304_100000183606 [0,1,0,0,0,0|2,0,1]=4 1371 B15R1.127 Cc1cccc(c1)OCC(=O)NCCO 527a_100000210304_100000183606 [0,1,0,0,0,0|2,0,1]=4 1372 B15R1.127 Cc1cccc(c1)OCC(C)OCC=O 34a_200011219432_200009817547 [0,1,0,0,0,0|2,0,1]=4 1373 B15R1.127 Cc1cccc(c1)OCC(C)OCC=O 7a_200011219432_200015260668 [0,1,0,0,0,0|2,0,1]=4 1374 B15R1.127 N#CCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100011215226 [0,1,0,0,0,0|2,0,1]=4 1375 B15R1.127 N#CCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100011215226 [0,1,0,0,0,0|2,0,1]=4 1376 B15R1.127 N#CCCC(=O)COc1cccc(c1)F 1458a_100000182781_100011215226 [0,1,0,0,0,0|2,0,1]=4 1377 B15R1.127 N#CCNC(=O)COc1cccc(c1)Br 1626a_100000734998_100000182359 [0,1,0,0,0,0|2,0,1]=4 1378 B15R1.127 N#CCNC(=O)COc1cccc(c1)Br 527a_100000734998_100000182359 [0,1,0,0,0,0|2,0,1]=4 1379 B15R1.127 N#CCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000736037 [0,1,0,0,0,0|2,0,1]=4 1380 B15R1.127 N#CCNC(=O)COc1cccc(c1)Cl 1626a_100000734998_100000184978 [0,1,0,0,0,0|2,0,1]=4 1381 B15R1.127 N#CCNC(=O)COc1cccc(c1)Cl 527a_100000734998_100000184978 [0,1,0,0,0,0|2,0,1]=4 1382 B15R1.127 N#CCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000736037 [0,1,0,0,0,0|2,0,1]=4 1383 B15R1.127 N#CCNC(=O)COc1cccc(c1)F 1626a_100000734998_100000182781 [0,1,0,0,0,0|2,0,1]=4 1384 B15R1.127 N#CCNC(=O)COc1cccc(c1)F 527a_100000734998_100000182781 [0,1,0,0,0,0|2,0,1]=4 1385 B15R1.127 N#CCNC(=O)COc1cccc(c1)F 7a_100000210426_100000736037 [0,1,0,0,0,0|2,0,1]=4 1386 B15R1.127 N#CCNC(=O)COc1cccc(c1)I 7a_100000211634_100000736037 [0,1,0,0,0,0|2,0,1]=4 1387 B15R1.127 O=C(CCCF)COc1cccc(c1)Br 1458a_100000182359_100011934791 [0,1,0,0,0,0|2,0,1]=4 1388 B15R1.127 O=C(CCCF)COc1cccc(c1)Cl 1458a_100000184978_100011934791 [0,1,0,0,0,0|2,0,1]=4 1389 B15R1.127 O=C(CCCF)COc1cccc(c1)F 1458a_100000182781_100011934791 [0,1,0,0,0,0|2,0,1]=4 1390 B15R1.127 O=C(CCCO)COc1cccc(c1)Br 1458a_100000182359_100011215043 [0,1,0,0,0,0|2,0,1]=4 1391 B15R1.127 O=C(CCCO)COc1cccc(c1)Cl 1458a_100000184978_100011215043 [0,1,0,0,0,0|2,0,1]=4 1392 B15R1.127 O=C(CCCO)COc1cccc(c1)F 1458a_100000182781_100011215043 [0,1,0,0,0,0|2,0,1]=4 1393 B15R1.127 O=C(COc1cccc(c1)Br)NCCF 11a_100000724931_100000182359 [0,1,0,0,0,0|2,0,1]=4 1394 B15R1.127 O=C(COc1cccc(c1)Br)NCCF 1626a_100000724931_100000182359 [0,1,0,0,0,0|2,0,1]=4 1395 B15R1.127 O=C(COc1cccc(c1)Br)NCCF 240690a_100000724931_100000182359 [0,1,0,0,0,0|2,0,1]=4 1396 B15R1.127 O=C(COc1cccc(c1)Br)NCCF 527a_100000724931_100000182359 [0,1,0,0,0,0|2,0,1]=4 1397 B15R1.127 O=C(COc1cccc(c1)Br)NCCO 240690a_100000210304_100000182359 [0,1,0,0,0,0|2,0,1]=4 1398 B15R1.127 O=C(COc1cccc(c1)Br)NCCO 527a_100000210304_100000182359 [0,1,0,0,0,0|2,0,1]=4 1399 B15R1.127 O=C(COc1cccc(c1)Cl)NCCF 11a_100000724931_100000184978 [0,1,0,0,0,0|2,0,1]=4 1400 B15R1.127 O=C(COc1cccc(c1)Cl)NCCF 1626a_100000724931_100000184978 [0,1,0,0,0,0|2,0,1]=4 1401 B15R1.127 O=C(COc1cccc(c1)Cl)NCCF 240690a_100000724931_100000184978 [0,1,0,0,0,0|2,0,1]=4 1402 B15R1.127 O=C(COc1cccc(c1)Cl)NCCF 527a_100000724931_100000184978 [0,1,0,0,0,0|2,0,1]=4 1403 B15R1.127 O=C(COc1cccc(c1)Cl)NCCO 240690a_100000210304_100000184978 [0,1,0,0,0,0|2,0,1]=4 1404 B15R1.127 O=C(COc1cccc(c1)Cl)NCCO 527a_100000210304_100000184978 [0,1,0,0,0,0|2,0,1]=4 1405 B15R1.127 O=C(COc1cccc(c1)F)NCCF 11a_100000724931_100000182781 [0,1,0,0,0,0|2,0,1]=4 1406 B15R1.127 O=C(COc1cccc(c1)F)NCCF 1626a_100000724931_100000182781 [0,1,0,0,0,0|2,0,1]=4 1407 B15R1.127 O=C(COc1cccc(c1)F)NCCF 240690a_100000724931_100000182781 [0,1,0,0,0,0|2,0,1]=4 1408 B15R1.127 O=C(COc1cccc(c1)F)NCCF 527a_100000724931_100000182781 [0,1,0,0,0,0|2,0,1]=4 1409 B15R1.127 O=C(COc1cccc(c1)F)NCCO 240690a_100000210304_100000182781 [0,1,0,0,0,0|2,0,1]=4 1410 B15R1.127 O=C(COc1cccc(c1)F)NCCO 527a_100000210304_100000182781 [0,1,0,0,0,0|2,0,1]=4 1411 B15R1.139 C#CCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000753159 [0,1,0,0,0,0|1,0,2]=4 1412 B15R1.139 C#CCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000753159 [0,1,0,0,0,0|1,0,2]=4 1413 B15R1.139 C#CCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000753159 [0,1,0,0,0,0|1,0,2]=4 1414 B15R1.139 C#CCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000753159 [0,1,0,0,0,0|1,0,2]=4 1415 B15R1.139 C#CCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000753159 [0,1,0,0,0,0|1,0,2]=4 1416 B15R1.139 C#CCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000753159 [0,1,0,0,0,0|1,0,2]=4 1417 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Br 11a_100000212058_100000182358 [0,1,0,0,0,0|1,0,2]=4 1418 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Br 1626a_100000212058_100000182358 [0,1,0,0,0,0|1,0,2]=4 1419 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Br 240690a_100000212058_100000182358 [0,1,0,0,0,0|1,0,2]=4 1420 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Br 527a_100000212058_100000182358 [0,1,0,0,0,0|1,0,2]=4 1421 B15R1.139 C#CCNC(=O)COc1ccc(cc1)C 11a_100000212058_100000182360 [0,1,0,0,0,0|1,0,2]=4 1422 B15R1.139 C#CCNC(=O)COc1ccc(cc1)C 1626a_100000212058_100000182360 [0,1,0,0,0,0|1,0,2]=4 1423 B15R1.139 C#CCNC(=O)COc1ccc(cc1)C 240690a_100000212058_100000182360 [0,1,0,0,0,0|1,0,2]=4 1424 B15R1.139 C#CCNC(=O)COc1ccc(cc1)C 527a_100000212058_100000182360 [0,1,0,0,0,0|1,0,2]=4 1425 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 11a_100000212058_100016990877 [0,1,0,0,0,0|1,0,2]=4 1426 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 1626a_100000212058_100016990877 [0,1,0,0,0,0|1,0,2]=4 1427 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 240690a_100000212058_100016990877 [0,1,0,0,0,0|1,0,2]=4 1428 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 527a_100000212058_100016990877 [0,1,0,0,0,0|1,0,2]=4 1429 B15R1.139 C#CCNC(=O)COc1ccc(cc1)F 11a_100000212058_100000184765 [0,1,0,0,0,0|1,0,2]=4 1430 B15R1.139 C#CCNC(=O)COc1ccc(cc1)F 1626a_100000212058_100000184765 [0,1,0,0,0,0|1,0,2]=4 1431 B15R1.139 C#CCNC(=O)COc1ccc(cc1)F 240690a_100000212058_100000184765 [0,1,0,0,0,0|1,0,2]=4 1432 B15R1.139 C#CCNC(=O)COc1ccc(cc1)F 527a_100000212058_100000184765 [0,1,0,0,0,0|1,0,2]=4 1433 B15R1.139 C#CCNC(=O)COc1ccc(cc1)I 11a_100000212058_100000184369 [0,1,0,0,0,0|1,0,2]=4 1434 B15R1.139 C#CCNC(=O)COc1ccc(cc1)I 1626a_100000212058_100000184369 [0,1,0,0,0,0|1,0,2]=4 1435 B15R1.139 C#CCNC(=O)COc1ccc(cc1)I 240690a_100000212058_100000184369 [0,1,0,0,0,0|1,0,2]=4 1436 B15R1.139 C#CCNC(=O)COc1ccc(cc1)I 527a_100000212058_100000184369 [0,1,0,0,0,0|1,0,2]=4 1437 B15R1.139 C#CCNC(=O)COc1ccc(cc1)O 240690a_100000212058_100000031633 [0,1,0,0,0,0|1,0,2]=4 1438 B15R1.139 C#CCNC(=O)COc1ccc(cc1)O 527a_100000212058_100000031633 [0,1,0,0,0,0|1,0,2]=4 1439 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)Br 1458a_100000182358_100102629194 [0,1,0,0,0,0|1,0,2]=4 1440 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)C 1458a_100000182360_100102629194 [0,1,0,0,0,0|1,0,2]=4 1441 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100102629194 [0,1,0,0,0,0|1,0,2]=4 1442 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)F 1458a_100000184765_100102629194 [0,1,0,0,0,0|1,0,2]=4 1443 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)I 1458a_100000184369_100102629194 [0,1,0,0,0,0|1,0,2]=4 1444 B15R1.139 C/C=C/CC(=O)COc1ccc(cc1)O 1458a_100000031633_100102629194 [0,1,0,0,0,0|1,0,2]=4 1445 B15R1.139 C=C(COc1ccc(cc1)Br)OCOC 34a_100000185759_100000042856 [0,1,0,0,0,0|2,0,1]=4 1446 B15R1.139 C=C(COc1ccc(cc1)C)OCOC 34a_100000210336_100000042856 [0,1,0,0,0,0|2,0,1]=4 1447 B15R1.139 C=C(COc1ccc(cc1)Cl)OCOC 34a_100000210216_100000042856 [0,1,0,0,0,0|2,0,1]=4 1448 B15R1.139 C=C(COc1ccc(cc1)F)OCOC 34a_100000210339_100000042856 [0,1,0,0,0,0|2,0,1]=4 1449 B15R1.139 C=C(COc1ccc(cc1)I)OCOC 34a_100000212066_100000042856 [0,1,0,0,0,0|2,0,1]=4 1450 B15R1.139 C=C(COc1ccc(cc1)N)OCOC 34a_100000185829_100000042856 [0,1,0,0,0,0|2,0,1]=4 1451 B15R1.139 C=CC=CC(=O)CCc1ccc(cc1)Br 1458a_100016291481_100011740612 [0,1,0,0,0,0|2,0,1]=4 1452 B15R1.139 C=CC=CC(=O)CCc1ccc(cc1)C 1458a_100016291481_100011713686 [0,1,0,0,0,0|2,0,1]=4 1453 B15R1.139 C=CC=CC(=O)CCc1ccc(cc1)Cl 1458a_100016291481_100011713675 [0,1,0,0,0,0|2,0,1]=4 1454 B15R1.139 C=CC=CC(=O)CCc1ccc(cc1)F 1458a_100016291481_100011217392 [0,1,0,0,0,0|2,0,1]=4 1455 B15R1.139 C=CC=CC(=O)CCc1ccc(cc1)O 1458a_100016291481_100009816426 [0,1,0,0,0,0|2,0,1]=4 1456 B15R1.139 C=CCCC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_100000754431 [0,1,0,0,0,0|2,0,1]=4 1457 B15R1.139 C=CCCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000754431 [0,1,0,0,0,0|2,0,1]=4 1458 B15R1.139 C=CCCC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_100000754431 [0,1,0,0,0,0|2,0,1]=4 1459 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_100000754431 [0,1,0,0,0,0|2,0,1]=4 1460 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)Br 6a_100000186029_100000762624 [0,1,0,0,0,0|2,0,1]=4 1461 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_100000754431 [0,1,0,0,0,0|2,0,1]=4 1462 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000754431 [0,1,0,0,0,0|2,0,1]=4 1463 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_100000754431 [0,1,0,0,0,0|2,0,1]=4 1464 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)F 6a_100000210084_100000762624 [0,1,0,0,0,0|2,0,1]=4 1465 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_100000754431 [0,1,0,0,0,0|2,0,1]=4 1466 B15R1.139 C=CCCC(=O)C=Cc1ccc(cc1)I 6a_100000188517_100000762624 [0,1,0,0,0,0|2,0,1]=4 1467 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000754431 [0,1,0,0,0,0|2,0,0]=3 1468 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)Br 1458a_100000749702_100011740612 [0,1,0,0,0,0|2,0,0]=3 1469 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000754431 [0,1,0,0,0,0|2,0,0]=3 1470 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)C 1458a_100000749702_100011713686 [0,1,0,0,0,0|2,0,0]=3 1471 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000754431 [0,1,0,0,0,0|2,0,0]=3 1472 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)Cl 1458a_100000749702_100011713675 [0,1,0,0,0,0|2,0,0]=3 1473 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000754431 [0,1,0,0,0,0|2,0,0]=3 1474 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)F 1458a_100000749702_100011217392 [0,1,0,0,0,0|2,0,0]=3 1475 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000754431 [0,1,0,0,0,0|2,0,0]=3 1476 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000754431 [0,1,0,0,0,0|2,0,0]=3 1477 B15R1.139 C=CCCC(=O)CCc1ccc(cc1)O 1458a_100000749702_100009816426 [0,1,0,0,0,0|2,0,0]=3 1478 B15R1.139 C=CCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000754431 [0,1,0,0,0,0|1,0,0]=2 1479 B15R1.139 C=CCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000754431 [0,1,0,0,0,0|1,0,0]=2 1480 B15R1.139 C=CCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000754431 [0,1,0,0,0,0|1,0,0]=2 1481 B15R1.139 C=CCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000754431 [0,1,0,0,0,0|1,0,0]=2 1482 B15R1.139 C=CCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000754431 [0,1,0,0,0,0|1,0,0]=2 1483 B15R1.139 C=CCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000754431 [0,1,0,0,0,0|1,0,0]=2 1484 B15R1.139 C=CCCC(=O)COc1ncc(cn1)Br 1458a_200012356291_100000754431 [0,1,0,0,0,0|3,0,0]=4 1485 B15R1.139 C=CCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000754431 [0,1,0,0,0,0|1,1,0]=3 1486 B15R1.139 C=CCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000754431 [0,1,0,0,0,0|1,1,0]=3 1487 B15R1.139 C=CCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000754431 [0,1,0,0,0,0|1,1,0]=3 1488 B15R1.139 C=CCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000754431 [0,1,0,0,0,0|1,1,0]=3 1489 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000749702 [0,1,0,0,0,0|3,0,0]=4 1490 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000749702 [0,1,0,0,0,0|3,0,0]=4 1491 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000749702 [0,1,0,0,0,0|3,0,0]=4 1492 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000749702 [0,1,0,0,0,0|3,0,0]=4 1493 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000749702 [0,1,0,0,0,0|3,0,0]=4 1494 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000749702 [0,1,0,0,0,0|3,0,0]=4 1495 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000749702 [0,1,0,0,0,0|3,0,0]=4 1496 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000749702 [0,1,0,0,0,0|3,0,0]=4 1497 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000749702 [0,1,0,0,0,0|3,0,0]=4 1498 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000749702 [0,1,0,0,0,0|3,0,0]=4 1499 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000749702 [0,1,0,0,0,0|3,0,0]=4 1500 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000749702 [0,1,0,0,0,0|3,0,0]=4 1501 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000749702 [0,1,0,0,0,0|3,0,0]=4 1502 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000749702 [0,1,0,0,0,0|3,0,0]=4 1503 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000749702 [0,1,0,0,0,0|3,0,0]=4 1504 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000749702 [0,1,0,0,0,0|3,0,0]=4 1505 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000749702 [0,1,0,0,0,0|3,0,0]=4 1506 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000749702 [0,1,0,0,0,0|3,0,0]=4 1507 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000749702 [0,1,0,0,0,0|3,0,0]=4 1508 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000749702 [0,1,0,0,0,0|3,0,0]=4 1509 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000749702 [0,1,0,0,0,0|3,0,0]=4 1510 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000749702 [0,1,0,0,0,0|3,0,0]=4 1511 B15R1.139 C=CCCC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000749702 [0,1,0,0,0,0|3,0,0]=4 1512 B15R1.139 C=CCCC(=O)NNc1ccc(cc1)C 22a_100000683527_100000749702 [0,1,0,0,0,0|3,0,0]=4 1513 B15R1.139 C=CCCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000749702 [0,1,0,0,0,0|3,0,0]=4 1514 B15R1.139 C=CCCC(=O)NNc1ccc(cc1)F 22a_100000728448_100000749702 [0,1,0,0,0,0|3,0,0]=4 1515 B15R1.139 C=CCCC(=O)NNc1ccc(cc1)I 22a_100016988836_100000749702 [0,1,0,0,0,0|3,0,0]=4 1516 B15R1.139 C=CCNC(=O)C#Cc1ccc(cc1)Cl 240690a_100020586998_100011892723 [0,1,0,0,0,0|2,0,1]=4 1517 B15R1.139 C=CCNC(=O)C#Cc1ccc(cc1)F 240690a_100020586998_100000238512 [0,1,0,0,0,0|2,0,1]=4 1518 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Br 1626a_100020586998_100016267368 [0,1,0,0,0,0|2,0,1]=4 1519 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)C 1626a_100020586998_100000716854 [0,1,0,0,0,0|2,0,1]=4 1520 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)C 240690a_100020586998_100000716854 [0,1,0,0,0,0|2,0,1]=4 1521 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100020586998_100000184863 [0,1,0,0,0,0|2,0,1]=4 1522 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100020586998_100000184863 [0,1,0,0,0,0|2,0,1]=4 1523 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)F 1626a_100020586998_100000182136 [0,1,0,0,0,0|2,0,1]=4 1524 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)F 240690a_100020586998_100000182136 [0,1,0,0,0,0|2,0,1]=4 1525 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)I 1626a_100020586998_100102526154 [0,1,0,0,0,0|2,0,1]=4 1526 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)I 240690a_100020586998_100102526154 [0,1,0,0,0,0|2,0,1]=4 1527 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)O 240690a_100020586998_100016269017 [0,1,0,0,0,0|2,0,1]=4 1528 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Br 1626a_100020586998_100000217147 [0,1,0,0,0,0|2,0,0]=3 1529 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Br 240690a_100020586998_100000217147 [0,1,0,0,0,0|2,0,0]=3 1530 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Br 527a_100020586998_100000217147 [0,1,0,0,0,0|2,0,0]=3 1531 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)C 1626a_100020586998_100000234883 [0,1,0,0,0,0|2,0,0]=3 1532 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)C 240690a_100020586998_100000234883 [0,1,0,0,0,0|2,0,0]=3 1533 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)C 527a_100020586998_100000234883 [0,1,0,0,0,0|2,0,0]=3 1534 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 1626a_100020586998_100000235379 [0,1,0,0,0,0|2,0,0]=3 1535 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 240690a_100020586998_100000235379 [0,1,0,0,0,0|2,0,0]=3 1536 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 527a_100020586998_100000235379 [0,1,0,0,0,0|2,0,0]=3 1537 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)F 1626a_100020586998_100000198493 [0,1,0,0,0,0|2,0,0]=3 1538 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)F 240690a_100020586998_100000198493 [0,1,0,0,0,0|2,0,0]=3 1539 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)F 527a_100020586998_100000198493 [0,1,0,0,0,0|2,0,0]=3 1540 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)I 1626a_100020586998_100011217499 [0,1,0,0,0,0|2,0,0]=3 1541 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)I 240690a_100020586998_100011217499 [0,1,0,0,0,0|2,0,0]=3 1542 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)I 527a_100020586998_100011217499 [0,1,0,0,0,0|2,0,0]=3 1543 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)O 240690a_100020586998_100000742835 [0,1,0,0,0,0|2,0,0]=3 1544 B15R1.139 C=CCNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183597 [0,1,0,0,0,0|2,0,0]=3 1545 B15R1.139 C=CCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183597 [0,1,0,0,0,0|2,0,0]=3 1546 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Br 1626a_100020586998_100000182358 [0,1,0,0,0,0|1,0,0]=2 1547 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Br 240690a_100020586998_100000182358 [0,1,0,0,0,0|1,0,0]=2 1548 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Br 527a_100020586998_100000182358 [0,1,0,0,0,0|1,0,0]=2 1549 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183597 [0,1,0,0,0,0|1,0,0]=2 1550 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C 1626a_100020586998_100000182360 [0,1,0,0,0,0|1,0,0]=2 1551 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C 240690a_100020586998_100000182360 [0,1,0,0,0,0|1,0,0]=2 1552 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C 527a_100020586998_100000182360 [0,1,0,0,0,0|1,0,0]=2 1553 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183597 [0,1,0,0,0,0|1,0,0]=2 1554 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 1626a_100020586998_100016990877 [0,1,0,0,0,0|1,0,0]=2 1555 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 240690a_100020586998_100016990877 [0,1,0,0,0,0|1,0,0]=2 1556 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 527a_100020586998_100016990877 [0,1,0,0,0,0|1,0,0]=2 1557 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183597 [0,1,0,0,0,0|1,0,0]=2 1558 B15R1.139 C=CCNC(=O)COc1ccc(cc1)F 1626a_100020586998_100000184765 [0,1,0,0,0,0|1,0,0]=2 1559 B15R1.139 C=CCNC(=O)COc1ccc(cc1)F 240690a_100020586998_100000184765 [0,1,0,0,0,0|1,0,0]=2 1560 B15R1.139 C=CCNC(=O)COc1ccc(cc1)F 527a_100020586998_100000184765 [0,1,0,0,0,0|1,0,0]=2 1561 B15R1.139 C=CCNC(=O)COc1ccc(cc1)I 1626a_100020586998_100000184369 [0,1,0,0,0,0|1,0,0]=2 1562 B15R1.139 C=CCNC(=O)COc1ccc(cc1)I 240690a_100020586998_100000184369 [0,1,0,0,0,0|1,0,0]=2 1563 B15R1.139 C=CCNC(=O)COc1ccc(cc1)I 527a_100020586998_100000184369 [0,1,0,0,0,0|1,0,0]=2 1564 B15R1.139 C=CCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183597 [0,1,0,0,0,0|1,0,0]=2 1565 B15R1.139 C=CCNC(=O)COc1ccc(cc1)O 240690a_100020586998_100000031633 [0,1,0,0,0,0|1,0,0]=2 1566 B15R1.139 C=CCNC(=O)COc1ccc(cc1)O 527a_100020586998_100000031633 [0,1,0,0,0,0|1,0,0]=2 1567 B15R1.139 C=CCNC(=O)COc1ccc(nc1)Br 7a_100000685995_100000183597 [0,1,0,0,0,0|2,0,0]=3 1568 B15R1.139 C=CCNC(=O)COc1ccc(nc1)C 7a_100000745506_100000183597 [0,1,0,0,0,0|2,0,0]=3 1569 B15R1.139 C=CCNC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000183597 [0,1,0,0,0,0|2,0,0]=3 1570 B15R1.139 C=CCNC(=O)COc1ccc(nc1)F 7a_100000688820_100000183597 [0,1,0,0,0,0|2,0,0]=3 1571 B15R1.139 C=CCNC(=O)COc1ccc(nc1)I 7a_100000687607_100000183597 [0,1,0,0,0,0|2,0,0]=3 1572 B15R1.139 C=CCNC(=O)COc1ccc(nc1)N 7a_100015188713_100000183597 [0,1,0,0,0,0|2,0,0]=3 1573 B15R1.139 C=CCNC(=O)COc1cnc(nc1)Br 7a_100000730009_100000183597 [0,1,0,0,0,0|3,0,0]=4 1574 B15R1.139 C=CCNC(=O)COc1cnc(nc1)C 7a_100000062939_100000183597 [0,1,0,0,0,0|3,0,0]=4 1575 B15R1.139 C=CCNC(=O)COc1cnc(nc1)Cl 7a_100000092845_100000183597 [0,1,0,0,0,0|3,0,0]=4 1576 B15R1.139 C=CCNC(=O)COc1cnc(nc1)F 7a_200009874573_100000183597 [0,1,0,0,0,0|3,0,0]=4 1577 B15R1.139 C=CCNC(=O)COc1cnc(nc1)N 7a_100000087137_100000183597 [0,1,0,0,0,0|3,0,0]=4 1578 B15R1.139 C=CCNC(=O)COc1ncc(cn1)Br 240690a_100020586998_200012356291 [0,1,0,0,0,0|3,0,0]=4 1579 B15R1.139 C=CCNC(=O)COc1ncc(cn1)Br 527a_100020586998_200012356291 [0,1,0,0,0,0|3,0,0]=4 1580 B15R1.139 C=CCNC(=O)CSc1cc[n+](cc1)[O-] 62a_100000183597_100000039755 [0,1,0,0,0,0|2,1,0]=4 1581 B15R1.139 C=CCNC(=O)CSc1ccc(=O)[nH]c1 62a_100000183597_100000212171 [0,1,0,0,0,0|2,1,0]=4 1582 B15R1.139 C=CCNC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000183597 [0,1,0,0,0,0|2,1,0]=4 1583 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Br 1626a_100020586998_100000179496 [0,1,0,0,0,0|1,1,0]=3 1584 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Br 240690a_100020586998_100000179496 [0,1,0,0,0,0|1,1,0]=3 1585 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Br 527a_100020586998_100000179496 [0,1,0,0,0,0|1,1,0]=3 1586 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Br 62a_100000183597_100000752885 [0,1,0,0,0,0|1,1,0]=3 1587 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183597 [0,1,0,0,0,0|1,1,0]=3 1588 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C 1626a_100020586998_100000179497 [0,1,0,0,0,0|1,1,0]=3 1589 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C 240690a_100020586998_100000179497 [0,1,0,0,0,0|1,1,0]=3 1590 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C 527a_100020586998_100000179497 [0,1,0,0,0,0|1,1,0]=3 1591 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C 62a_100000183597_100000186775 [0,1,0,0,0,0|1,1,0]=3 1592 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183597 [0,1,0,0,0,0|1,1,0]=3 1593 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 1626a_100020586998_100000178402 [0,1,0,0,0,0|1,1,0]=3 1594 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 240690a_100020586998_100000178402 [0,1,0,0,0,0|1,1,0]=3 1595 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 527a_100020586998_100000178402 [0,1,0,0,0,0|1,1,0]=3 1596 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 62a_100000183597_100000755918 [0,1,0,0,0,0|1,1,0]=3 1597 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183597 [0,1,0,0,0,0|1,1,0]=3 1598 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)F 1626a_100020586998_100000691584 [0,1,0,0,0,0|1,1,0]=3 1599 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)F 240690a_100020586998_100000691584 [0,1,0,0,0,0|1,1,0]=3 1600 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)F 527a_100020586998_100000691584 [0,1,0,0,0,0|1,1,0]=3 1601 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)F 62a_100000183597_100000211213 [0,1,0,0,0,0|1,1,0]=3 1602 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183597 [0,1,0,0,0,0|1,1,0]=3 1603 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)N 62a_100000183597_100000185761 [0,1,0,0,0,0|1,1,0]=3 1604 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183597 [0,1,0,0,0,0|1,1,0]=3 1605 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)O 62a_100000183597_100000185759 [0,1,0,0,0,0|1,1,0]=3 1606 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)Br 62a_100000183597_100000686858 [0,1,0,0,0,0|2,1,0]=4 1607 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000183597 [0,1,0,0,0,0|2,1,0]=4 1608 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)C 62a_100000183597_100000754016 [0,1,0,0,0,0|2,1,0]=4 1609 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)C 62a_100011192072_100000183597 [0,1,0,0,0,0|2,1,0]=4 1610 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)Cl 62a_100000183597_100011356976 [0,1,0,0,0,0|2,1,0]=4 1611 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000183597 [0,1,0,0,0,0|2,1,0]=4 1612 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)F 62a_100000183597_100000744514 [0,1,0,0,0,0|2,1,0]=4 1613 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)F 62a_100000744514_100000183597 [0,1,0,0,0,0|2,1,0]=4 1614 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)N 62a_100000183597_100000737798 [0,1,0,0,0,0|2,1,0]=4 1615 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)N 62a_100000737798_100000183597 [0,1,0,0,0,0|2,1,0]=4 1616 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)O 62a_100000183597_100000744096 [0,1,0,0,0,0|2,1,0]=4 1617 B15R1.139 C=CCNC(=O)CSc1ccc(cn1)O 62a_100000685995_100000183597 [0,1,0,0,0,0|2,1,0]=4 1618 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)Br 62a_100000183597_100009814638 [0,1,0,0,0,0|2,1,0]=4 1619 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000183597 [0,1,0,0,0,0|2,1,0]=4 1620 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)C 62a_100000183597_100000751577 [0,1,0,0,0,0|2,1,0]=4 1621 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)C 62a_100000751577_100000183597 [0,1,0,0,0,0|2,1,0]=4 1622 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000183597 [0,1,0,0,0,0|2,1,0]=4 1623 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)Cl 62a_100000183597_100000034144 [0,1,0,0,0,0|2,1,0]=4 1624 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)F 62a_100000042367_100000183597 [0,1,0,0,0,0|2,1,0]=4 1625 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)F 62a_100000183597_100000042367 [0,1,0,0,0,0|2,1,0]=4 1626 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)N 62a_100000183597_100000187370 [0,1,0,0,0,0|2,1,0]=4 1627 B15R1.139 C=CCNC(=O)CSc1ccc(nc1)N 62a_100000187370_100000183597 [0,1,0,0,0,0|2,1,0]=4 1628 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_100020586998 [0,1,0,0,0,0|3,0,0]=4 1629 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100020586998 [0,1,0,0,0,0|3,0,0]=4 1630 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Br 273464a_100020586998_100000174875 [0,1,0,0,0,0|3,0,0]=4 1631 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100020586998 [0,1,0,0,0,0|3,0,0]=4 1632 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Br 512a_100020586998_100000174875 [0,1,0,0,0,0|3,0,0]=4 1633 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C 2708a_100000174908_100020586998 [0,1,0,0,0,0|3,0,0]=4 1634 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100020586998 [0,1,0,0,0,0|3,0,0]=4 1635 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C 273464a_100020586998_100000174908 [0,1,0,0,0,0|3,0,0]=4 1636 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C 512a_100000174908_100020586998 [0,1,0,0,0,0|3,0,0]=4 1637 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C 512a_100020586998_100000174908 [0,1,0,0,0,0|3,0,0]=4 1638 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100020586998 [0,1,0,0,0,0|3,0,0]=4 1639 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100020586998 [0,1,0,0,0,0|3,0,0]=4 1640 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 273464a_100020586998_100000174871 [0,1,0,0,0,0|3,0,0]=4 1641 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 512a_100020586998_100000174871 [0,1,0,0,0,0|3,0,0]=4 1642 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)F 2708a_100000174882_100020586998 [0,1,0,0,0,0|3,0,0]=4 1643 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100020586998 [0,1,0,0,0,0|3,0,0]=4 1644 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)F 273464a_100020586998_100000174882 [0,1,0,0,0,0|3,0,0]=4 1645 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)F 512a_100000174882_100020586998 [0,1,0,0,0,0|3,0,0]=4 1646 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)F 512a_100020586998_100000174882 [0,1,0,0,0,0|3,0,0]=4 1647 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)I 2708a_100016989417_100020586998 [0,1,0,0,0,0|3,0,0]=4 1648 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100020586998 [0,1,0,0,0,0|3,0,0]=4 1649 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)I 273464a_100020586998_100016989417 [0,1,0,0,0,0|3,0,0]=4 1650 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)I 512a_100016989417_100020586998 [0,1,0,0,0,0|3,0,0]=4 1651 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)I 512a_100020586998_100016989417 [0,1,0,0,0,0|3,0,0]=4 1652 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)O 2708a_100000185549_100020586998 [0,1,0,0,0,0|3,0,0]=4 1653 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100020586998 [0,1,0,0,0,0|3,0,0]=4 1654 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)O 273464a_100020586998_100000185549 [0,1,0,0,0,0|3,0,0]=4 1655 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)O 512a_100020586998_100000185549 [0,1,0,0,0,0|3,0,0]=4 1656 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Br 273464a_100020586998_100000735608 [0,1,0,0,0,0|3,0,0]=4 1657 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Br 512a_100020586998_100000735608 [0,1,0,0,0,0|3,0,0]=4 1658 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)C 273464a_100020586998_100000683527 [0,1,0,0,0,0|3,0,0]=4 1659 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)C 512a_100020586998_100000683527 [0,1,0,0,0,0|3,0,0]=4 1660 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Cl 273464a_100020586998_100000683521 [0,1,0,0,0,0|3,0,0]=4 1661 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Cl 512a_100020586998_100000683521 [0,1,0,0,0,0|3,0,0]=4 1662 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)F 273464a_100020586998_100000728448 [0,1,0,0,0,0|3,0,0]=4 1663 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)F 512a_100020586998_100000728448 [0,1,0,0,0,0|3,0,0]=4 1664 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)I 273464a_100020586998_100016988836 [0,1,0,0,0,0|3,0,0]=4 1665 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)I 512a_100020586998_100016988836 [0,1,0,0,0,0|3,0,0]=4 1666 B15R1.139 C=CCNC(C)COc1ccc(cc1)C 2230a_100000743913_100000210623 [0,1,0,0,0,0|2,0,1]=4 1667 B15R1.139 C=CCNC(C)COc1ccc(cc1)C 34a_100000743913_100015514636 [0,1,0,0,0,0|2,0,1]=4 1668 B15R1.139 C=CCNC(C)COc1ccc(cc1)Cl 270004a_100020586998_200000150450 [0,1,0,0,0,0|2,0,1]=4 1669 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000033060 [0,1,0,0,0,0|1,0,0]=2 1670 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000033060 [0,1,0,0,0,0|1,0,0]=2 1671 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)C 34a_100000124888_100000033060 [0,1,0,0,0,0|1,0,0]=2 1672 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000033060 [0,1,0,0,0,0|1,0,0]=2 1673 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000033060 [0,1,0,0,0,0|1,0,0]=2 1674 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)F 34a_100000185862_100000033060 [0,1,0,0,0,0|1,0,0]=2 1675 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)I 34a_100000185761_100000033060 [0,1,0,0,0,0|1,0,0]=2 1676 B15R1.139 C=CCOC(=O)CNc1ccc(cc1)O 34a_100000185829_100000033060 [0,1,0,0,0,0|1,0,0]=2 1677 B15R1.139 C=CCOC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000033060 [0,1,0,0,0,0|1,0,0]=2 1678 B15R1.139 C=CCOC(=O)COc1ccc(cc1)Br 34a_100000185759_100000033060 [0,1,0,0,0,0|0,0,0]=1 1679 B15R1.139 C=CCOC(=O)COc1ccc(cc1)Br 7a_100000185759_100000033060 [0,1,0,0,0,0|0,0,0]=1 1680 B15R1.139 C=CCOC(=O)COc1ccc(cc1)C 34a_100000210336_100000033060 [0,1,0,0,0,0|0,0,0]=1 1681 B15R1.139 C=CCOC(=O)COc1ccc(cc1)C 7a_100000210336_100000033060 [0,1,0,0,0,0|0,0,0]=1 1682 B15R1.139 C=CCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000033060 [0,1,0,0,0,0|0,0,0]=1 1683 B15R1.139 C=CCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000033060 [0,1,0,0,0,0|0,0,0]=1 1684 B15R1.139 C=CCOC(=O)COc1ccc(cc1)F 34a_100000210339_100000033060 [0,1,0,0,0,0|0,0,0]=1 1685 B15R1.139 C=CCOC(=O)COc1ccc(cc1)I 34a_100000212066_100000033060 [0,1,0,0,0,0|0,0,0]=1 1686 B15R1.139 C=CCOC(=O)COc1ccc(cc1)I 7a_100000212066_100000033060 [0,1,0,0,0,0|0,0,0]=1 1687 B15R1.139 C=CCOC(=O)COc1ccc(cc1)N 34a_100000185829_100000033060 [0,1,0,0,0,0|0,0,0]=1 1688 B15R1.139 C=CCOC(=O)COc1ccc(cn1)C 34a_100000759353_100000033060 [0,1,0,0,0,0|1,0,0]=2 1689 B15R1.139 C=CCOC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000033060 [0,1,0,0,0,0|1,0,0]=2 1690 B15R1.139 C=CCOC(=O)COc1ccc(cn1)F 34a_100000742473_100000033060 [0,1,0,0,0,0|1,0,0]=2 1691 B15R1.139 C=CCOC(=O)COc1ccc(cn1)N 34a_100000729260_100000033060 [0,1,0,0,0,0|1,0,0]=2 1692 B15R1.139 C=CCOC(=O)COc1ccc(nc1)Br 34a_100000685995_100000033060 [0,1,0,0,0,0|1,0,0]=2 1693 B15R1.139 C=CCOC(=O)COc1ccc(nc1)Br 7a_100000685995_100000033060 [0,1,0,0,0,0|1,0,0]=2 1694 B15R1.139 C=CCOC(=O)COc1ccc(nc1)C 34a_100000745506_100000033060 [0,1,0,0,0,0|1,0,0]=2 1695 B15R1.139 C=CCOC(=O)COc1ccc(nc1)C 7a_100000745506_100000033060 [0,1,0,0,0,0|1,0,0]=2 1696 B15R1.139 C=CCOC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000033060 [0,1,0,0,0,0|1,0,0]=2 1697 B15R1.139 C=CCOC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000033060 [0,1,0,0,0,0|1,0,0]=2 1698 B15R1.139 C=CCOC(=O)COc1ccc(nc1)F 34a_100000688820_100000033060 [0,1,0,0,0,0|1,0,0]=2 1699 B15R1.139 C=CCOC(=O)COc1ccc(nc1)F 7a_100000688820_100000033060 [0,1,0,0,0,0|1,0,0]=2 1700 B15R1.139 C=CCOC(=O)COc1ccc(nc1)I 34a_100000687607_100000033060 [0,1,0,0,0,0|1,0,0]=2 1701 B15R1.139 C=CCOC(=O)COc1ccc(nc1)I 7a_100000687607_100000033060 [0,1,0,0,0,0|1,0,0]=2 1702 B15R1.139 C=CCOC(=O)COc1ccc(nc1)N 34a_100015188713_100000033060 [0,1,0,0,0,0|1,0,0]=2 1703 B15R1.139 C=CCOC(=O)COc1ccc(nc1)N 7a_100015188713_100000033060 [0,1,0,0,0,0|1,0,0]=2 1704 B15R1.139 C=CCOC(=O)COc1cnc(cn1)Br 34a_100011934580_100000033060 [0,1,0,0,0,0|2,0,0]=3 1705 B15R1.139 C=CCOC(=O)COc1cnc(cn1)Cl 34a_100015839800_100000033060 [0,1,0,0,0,0|2,0,0]=3 1706 B15R1.139 C=CCOC(=O)COc1cnc(nc1)Br 34a_100000730009_100000033060 [0,1,0,0,0,0|2,0,0]=3 1707 B15R1.139 C=CCOC(=O)COc1cnc(nc1)Br 7a_100000730009_100000033060 [0,1,0,0,0,0|2,0,0]=3 1708 B15R1.139 C=CCOC(=O)COc1cnc(nc1)C 34a_100000062939_100000033060 [0,1,0,0,0,0|2,0,0]=3 1709 B15R1.139 C=CCOC(=O)COc1cnc(nc1)C 7a_100000062939_100000033060 [0,1,0,0,0,0|2,0,0]=3 1710 B15R1.139 C=CCOC(=O)COc1cnc(nc1)Cl 34a_100000092845_100000033060 [0,1,0,0,0,0|2,0,0]=3 1711 B15R1.139 C=CCOC(=O)COc1cnc(nc1)Cl 7a_100000092845_100000033060 [0,1,0,0,0,0|2,0,0]=3 1712 B15R1.139 C=CCOC(=O)COc1cnc(nc1)F 34a_200009874573_100000033060 [0,1,0,0,0,0|2,0,0]=3 1713 B15R1.139 C=CCOC(=O)COc1cnc(nc1)F 7a_200009874573_100000033060 [0,1,0,0,0,0|2,0,0]=3 1714 B15R1.139 C=CCOC(=O)COc1cnc(nc1)N 34a_100000087137_100000033060 [0,1,0,0,0,0|2,0,0]=3 1715 B15R1.139 C=CCOC(=O)COc1cnc(nc1)N 7a_100000087137_100000033060 [0,1,0,0,0,0|2,0,0]=3 1716 B15R1.139 C=CCOC(=O)COc1ncc(cn1)F 34a_100011934040_100000033060 [0,1,0,0,0,0|2,0,0]=3 1717 B15R1.139 C=CCOC(=O)CSc1cc[n+](cc1)[O-] 62a_100000033060_100000039755 [0,1,0,0,0,0|1,1,0]=3 1718 B15R1.139 C=CCOC(=O)CSc1ccc(=O)[nH]c1 62a_100000033060_100000212171 [0,1,0,0,0,0|1,1,0]=3 1719 B15R1.139 C=CCOC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000033060 [0,1,0,0,0,0|1,1,0]=3 1720 B15R1.139 C=CCOC(=O)CSc1ccc(=O)[nH]n1 62a_100000033060_100009820020 [0,1,0,0,0,0|2,1,0]=4 1721 B15R1.139 C=CCOC(=O)CSc1ccc(=O)[nH]n1 62a_100009820020_100000033060 [0,1,0,0,0,0|2,1,0]=4 1722 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)Br 62a_100000033060_100000752885 [0,1,0,0,0,0|0,1,0]=2 1723 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000033060 [0,1,0,0,0,0|0,1,0]=2 1724 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)C 62a_100000033060_100000186775 [0,1,0,0,0,0|0,1,0]=2 1725 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)C 62a_100000186775_100000033060 [0,1,0,0,0,0|0,1,0]=2 1726 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)Cl 62a_100000033060_100000755918 [0,1,0,0,0,0|0,1,0]=2 1727 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000033060 [0,1,0,0,0,0|0,1,0]=2 1728 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)F 62a_100000033060_100000211213 [0,1,0,0,0,0|0,1,0]=2 1729 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)F 62a_100000211213_100000033060 [0,1,0,0,0,0|0,1,0]=2 1730 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)N 62a_100000033060_100000185761 [0,1,0,0,0,0|0,1,0]=2 1731 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)N 62a_100000185761_100000033060 [0,1,0,0,0,0|0,1,0]=2 1732 B15R1.139 C=CCOC(=O)CSc1ccc(cc1)O 62a_100000033060_100000185759 [0,1,0,0,0,0|0,1,0]=2 1733 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)Br 62a_100000033060_100000686858 [0,1,0,0,0,0|1,1,0]=3 1734 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000033060 [0,1,0,0,0,0|1,1,0]=3 1735 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)C 62a_100000033060_100000754016 [0,1,0,0,0,0|1,1,0]=3 1736 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)C 62a_100011192072_100000033060 [0,1,0,0,0,0|1,1,0]=3 1737 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)Cl 62a_100000033060_100011356976 [0,1,0,0,0,0|1,1,0]=3 1738 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000033060 [0,1,0,0,0,0|1,1,0]=3 1739 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)F 62a_100000033060_100000744514 [0,1,0,0,0,0|1,1,0]=3 1740 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)F 62a_100000744514_100000033060 [0,1,0,0,0,0|1,1,0]=3 1741 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)N 62a_100000033060_100000737798 [0,1,0,0,0,0|1,1,0]=3 1742 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)N 62a_100000737798_100000033060 [0,1,0,0,0,0|1,1,0]=3 1743 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)O 62a_100000033060_100000744096 [0,1,0,0,0,0|1,1,0]=3 1744 B15R1.139 C=CCOC(=O)CSc1ccc(cn1)O 62a_100000685995_100000033060 [0,1,0,0,0,0|1,1,0]=3 1745 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)Br 62a_100000033060_100009814638 [0,1,0,0,0,0|1,1,0]=3 1746 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000033060 [0,1,0,0,0,0|1,1,0]=3 1747 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)C 62a_100000033060_100000751577 [0,1,0,0,0,0|1,1,0]=3 1748 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)C 62a_100000751577_100000033060 [0,1,0,0,0,0|1,1,0]=3 1749 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)Cl 62a_100000033060_100000034144 [0,1,0,0,0,0|1,1,0]=3 1750 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000033060 [0,1,0,0,0,0|1,1,0]=3 1751 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)F 62a_100000033060_100000042367 [0,1,0,0,0,0|1,1,0]=3 1752 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)F 62a_100000042367_100000033060 [0,1,0,0,0,0|1,1,0]=3 1753 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)N 62a_100000033060_100000187370 [0,1,0,0,0,0|1,1,0]=3 1754 B15R1.139 C=CCOC(=O)CSc1ccc(nc1)N 62a_100000187370_100000033060 [0,1,0,0,0,0|1,1,0]=3 1755 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)C 62a_100000033060_100000744512 [0,1,0,0,0,0|2,1,0]=4 1756 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)C 62a_100000744512_100000033060 [0,1,0,0,0,0|2,1,0]=4 1757 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)Cl 62a_100000033060_100000068654 [0,1,0,0,0,0|2,1,0]=4 1758 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)Cl 62a_100000068654_100000033060 [0,1,0,0,0,0|2,1,0]=4 1759 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)N 62a_100000033060_100010219413 [0,1,0,0,0,0|2,1,0]=4 1760 B15R1.139 C=CCOC(=O)CSc1ccc(nn1)N 62a_100010219413_100000033060 [0,1,0,0,0,0|2,1,0]=4 1761 B15R1.139 C=CCOC(=O)CSc1cnc(=O)[nH]c1 62a_100000033060_102495366499 [0,1,0,0,0,0|2,1,0]=4 1762 B15R1.139 C=CCOC(=O)CSc1cnc(=O)[nH]c1 62a_102495366499_100000033060 [0,1,0,0,0,0|2,1,0]=4 1763 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)Br 62a_100000033060_100010187541 [0,1,0,0,0,0|2,1,0]=4 1764 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)Br 62a_100010187541_100000033060 [0,1,0,0,0,0|2,1,0]=4 1765 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)C 62a_100000033060_100011999403 [0,1,0,0,0,0|2,1,0]=4 1766 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)C 62a_100011999403_100000033060 [0,1,0,0,0,0|2,1,0]=4 1767 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)Cl 62a_100000033060_100010214907 [0,1,0,0,0,0|2,1,0]=4 1768 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)Cl 62a_100010214907_100000033060 [0,1,0,0,0,0|2,1,0]=4 1769 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)F 62a_100000033060_100009856528 [0,1,0,0,0,0|2,1,0]=4 1770 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)F 62a_100009856528_100000033060 [0,1,0,0,0,0|2,1,0]=4 1771 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)N 62a_100000033060_100000744751 [0,1,0,0,0,0|2,1,0]=4 1772 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)N 62a_100000744751_100000033060 [0,1,0,0,0,0|2,1,0]=4 1773 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)O 62a_100000033060_100015839800 [0,1,0,0,0,0|2,1,0]=4 1774 B15R1.139 C=CCOC(=O)CSc1cnc(cn1)O 62a_100011934580_100000033060 [0,1,0,0,0,0|2,1,0]=4 1775 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)Br 62a_100000033060_200012349914 [0,1,0,0,0,0|2,1,0]=4 1776 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)Br 62a_200012349914_100000033060 [0,1,0,0,0,0|2,1,0]=4 1777 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)C 62a_100000033060_100000686985 [0,1,0,0,0,0|2,1,0]=4 1778 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)C 62a_100000686985_100000033060 [0,1,0,0,0,0|2,1,0]=4 1779 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)Cl 62a_100000033060_100000059775 [0,1,0,0,0,0|2,1,0]=4 1780 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)Cl 62a_100000059775_100000033060 [0,1,0,0,0,0|2,1,0]=4 1781 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)F 62a_100000033060_100000685262 [0,1,0,0,0,0|2,1,0]=4 1782 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)F 62a_100000685262_100000033060 [0,1,0,0,0,0|2,1,0]=4 1783 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)N 62a_100000033060_100000766020 [0,1,0,0,0,0|2,1,0]=4 1784 B15R1.139 C=CCOC(=O)CSc1cnc(nc1)N 62a_100000766020_100000033060 [0,1,0,0,0,0|2,1,0]=4 1785 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)Br 62a_100000033060_100000690281 [0,1,0,0,0,0|2,1,0]=4 1786 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)Br 62a_100000690281_100000033060 [0,1,0,0,0,0|2,1,0]=4 1787 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)C 62a_100000033060_100000061069 [0,1,0,0,0,0|2,1,0]=4 1788 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)C 62a_100000061069_100000033060 [0,1,0,0,0,0|2,1,0]=4 1789 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)Cl 62a_100000033060_100011356929 [0,1,0,0,0,0|2,1,0]=4 1790 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)Cl 62a_100011356929_100000033060 [0,1,0,0,0,0|2,1,0]=4 1791 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)F 62a_100000033060_100000685220 [0,1,0,0,0,0|2,1,0]=4 1792 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)F 62a_100000685220_100000033060 [0,1,0,0,0,0|2,1,0]=4 1793 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)N 62a_100000033060_100000068403 [0,1,0,0,0,0|2,1,0]=4 1794 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)N 62a_100000068403_100000033060 [0,1,0,0,0,0|2,1,0]=4 1795 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)O 62a_100000033060_100000092845 [0,1,0,0,0,0|2,1,0]=4 1796 B15R1.139 C=CCOC(=O)CSc1ncc(cn1)O 62a_100000730009_100000033060 [0,1,0,0,0,0|2,1,0]=4 1797 B15R1.139 C=CCOC(C)COc1ccc(cc1)C 34a_100011217472_100015514636 [0,1,0,0,0,0|1,0,1]=3 1798 B15R1.139 C=CCOC(C)COc1ccc(cc1)C 7a_100011217472_100015514636 [0,1,0,0,0,0|1,0,1]=3 1799 B15R1.139 CC=CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000070051 [0,1,0,0,0,0|1,0,2]=4 1800 B15R1.139 CC=CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000070051 [0,1,0,0,0,0|1,0,2]=4 1801 B15R1.139 CC=CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000070051 [0,1,0,0,0,0|1,0,2]=4 1802 B15R1.139 CC=CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000070051 [0,1,0,0,0,0|1,0,2]=4 1803 B15R1.139 CC=CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000070051 [0,1,0,0,0,0|1,0,2]=4 1804 B15R1.139 CC=CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000070051 [0,1,0,0,0,0|1,0,2]=4 1805 B15R1.139 CC=NNC(=O)COc1ccc(cc1)Br 4a_100000182278_200000210099 [0,1,0,0,0,0|2,0,1]=4 1806 B15R1.139 CC=NNC(=O)COc1ccc(cc1)C 4a_100000183956_200000210099 [0,1,0,0,0,0|2,0,1]=4 1807 B15R1.139 CC=NNC(=O)COc1ccc(cc1)Cl 4a_100000182886_200000210099 [0,1,0,0,0,0|2,0,1]=4 1808 B15R1.139 CC=NNC(=O)COc1ccc(cc1)F 4a_100000184216_200000210099 [0,1,0,0,0,0|2,0,1]=4 1809 B15R1.139 CCCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210211 [0,1,0,0,0,0|1,0,2]=4 1810 B15R1.139 CCCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210211 [0,1,0,0,0,0|1,0,2]=4 1811 B15R1.139 CCCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210211 [0,1,0,0,0,0|1,0,2]=4 1812 B15R1.139 CCCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210211 [0,1,0,0,0,0|1,0,2]=4 1813 B15R1.139 CCCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210211 [0,1,0,0,0,0|1,0,2]=4 1814 B15R1.139 CCCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210211 [0,1,0,0,0,0|1,0,2]=4 1815 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 11a_100020643023_100000182358 [0,1,0,0,0,0|1,0,2]=4 1816 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 1626a_100020643023_100000182358 [0,1,0,0,0,0|1,0,2]=4 1817 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 240690a_100020643023_100000182358 [0,1,0,0,0,0|1,0,2]=4 1818 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183358 [0,1,0,0,0,0|1,0,2]=4 1819 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 527a_100020643023_100000182358 [0,1,0,0,0,0|1,0,2]=4 1820 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183358 [0,1,0,0,0,0|1,0,2]=4 1821 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 11a_100020643023_100000182360 [0,1,0,0,0,0|1,0,2]=4 1822 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 1626a_100020643023_100000182360 [0,1,0,0,0,0|1,0,2]=4 1823 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 240690a_100020643023_100000182360 [0,1,0,0,0,0|1,0,2]=4 1824 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183358 [0,1,0,0,0,0|1,0,2]=4 1825 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 527a_100020643023_100000182360 [0,1,0,0,0,0|1,0,2]=4 1826 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183358 [0,1,0,0,0,0|1,0,2]=4 1827 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 11a_100020643023_100016990877 [0,1,0,0,0,0|1,0,2]=4 1828 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 1626a_100020643023_100016990877 [0,1,0,0,0,0|1,0,2]=4 1829 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 240690a_100020643023_100016990877 [0,1,0,0,0,0|1,0,2]=4 1830 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183358 [0,1,0,0,0,0|1,0,2]=4 1831 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 527a_100020643023_100016990877 [0,1,0,0,0,0|1,0,2]=4 1832 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183358 [0,1,0,0,0,0|1,0,2]=4 1833 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 11a_100020643023_100000184765 [0,1,0,0,0,0|1,0,2]=4 1834 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 1626a_100020643023_100000184765 [0,1,0,0,0,0|1,0,2]=4 1835 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 240690a_100020643023_100000184765 [0,1,0,0,0,0|1,0,2]=4 1836 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183358 [0,1,0,0,0,0|1,0,2]=4 1837 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 527a_100020643023_100000184765 [0,1,0,0,0,0|1,0,2]=4 1838 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 11a_100020643023_100000184369 [0,1,0,0,0,0|1,0,2]=4 1839 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 1626a_100020643023_100000184369 [0,1,0,0,0,0|1,0,2]=4 1840 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 240690a_100020643023_100000184369 [0,1,0,0,0,0|1,0,2]=4 1841 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183358 [0,1,0,0,0,0|1,0,2]=4 1842 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 527a_100020643023_100000184369 [0,1,0,0,0,0|1,0,2]=4 1843 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183358 [0,1,0,0,0,0|1,0,2]=4 1844 B15R1.139 CCCNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183358 [0,1,0,0,0,0|1,0,2]=4 1845 B15R1.139 CCCNC(=O)COc1ccc(cc1)O 240690a_100020643023_100000031633 [0,1,0,0,0,0|1,0,2]=4 1846 B15R1.139 CCCNC(=O)COc1ccc(cc1)O 527a_100020643023_100000031633 [0,1,0,0,0,0|1,0,2]=4 1847 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Br 2230a_100000210018_200011215008 [0,1,0,0,0,0|1,0,2]=4 1848 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Br 34a_100000210018_200011215008 [0,1,0,0,0,0|1,0,2]=4 1849 B15R1.139 CCCOC(=O)CNc1ccc(cc1)C 34a_100000124888_200011215008 [0,1,0,0,0,0|1,0,2]=4 1850 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_200011215008 [0,1,0,0,0,0|1,0,2]=4 1851 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_200011215008 [0,1,0,0,0,0|1,0,2]=4 1852 B15R1.139 CCCOC(=O)CNc1ccc(cc1)F 34a_100000185862_200011215008 [0,1,0,0,0,0|1,0,2]=4 1853 B15R1.139 CCCOC(=O)CNc1ccc(cc1)I 34a_100000185761_200011215008 [0,1,0,0,0,0|1,0,2]=4 1854 B15R1.139 CCCOC(=O)CNc1ccc(cc1)O 34a_100000185829_200011215008 [0,1,0,0,0,0|1,0,2]=4 1855 B15R1.139 CCCOC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_200011215008 [0,1,0,0,0,0|1,0,2]=4 1856 B15R1.139 CCCOC(=O)COc1ccc(cc1)Br 34a_100000185759_200011215008 [0,1,0,0,0,0|0,0,2]=3 1857 B15R1.139 CCCOC(=O)COc1ccc(cc1)Br 7a_100000185759_200011215008 [0,1,0,0,0,0|0,0,2]=3 1858 B15R1.139 CCCOC(=O)COc1ccc(cc1)C 34a_100000210336_200011215008 [0,1,0,0,0,0|0,0,2]=3 1859 B15R1.139 CCCOC(=O)COc1ccc(cc1)C 7a_100000210336_200011215008 [0,1,0,0,0,0|0,0,2]=3 1860 B15R1.139 CCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_200011215008 [0,1,0,0,0,0|0,0,2]=3 1861 B15R1.139 CCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_200011215008 [0,1,0,0,0,0|0,0,2]=3 1862 B15R1.139 CCCOC(=O)COc1ccc(cc1)F 34a_100000210339_200011215008 [0,1,0,0,0,0|0,0,2]=3 1863 B15R1.139 CCCOC(=O)COc1ccc(cc1)I 34a_100000212066_200011215008 [0,1,0,0,0,0|0,0,2]=3 1864 B15R1.139 CCCOC(=O)COc1ccc(cc1)I 7a_100000212066_200011215008 [0,1,0,0,0,0|0,0,2]=3 1865 B15R1.139 CCCOC(=O)COc1ccc(cc1)N 34a_100000185829_200011215008 [0,1,0,0,0,0|0,0,2]=3 1866 B15R1.139 CCCOC(=O)COc1ccc(cn1)C 34a_100000759353_200011215008 [0,1,0,0,0,0|1,0,2]=4 1867 B15R1.139 CCCOC(=O)COc1ccc(cn1)Cl 34a_100011215309_200011215008 [0,1,0,0,0,0|1,0,2]=4 1868 B15R1.139 CCCOC(=O)COc1ccc(cn1)F 34a_100000742473_200011215008 [0,1,0,0,0,0|1,0,2]=4 1869 B15R1.139 CCCOC(=O)COc1ccc(cn1)N 34a_100000729260_200011215008 [0,1,0,0,0,0|1,0,2]=4 1870 B15R1.139 CCCOC(=O)COc1ccc(nc1)Br 34a_100000685995_200011215008 [0,1,0,0,0,0|1,0,2]=4 1871 B15R1.139 CCCOC(=O)COc1ccc(nc1)Br 7a_100000685995_200011215008 [0,1,0,0,0,0|1,0,2]=4 1872 B15R1.139 CCCOC(=O)COc1ccc(nc1)C 34a_100000745506_200011215008 [0,1,0,0,0,0|1,0,2]=4 1873 B15R1.139 CCCOC(=O)COc1ccc(nc1)C 7a_100000745506_200011215008 [0,1,0,0,0,0|1,0,2]=4 1874 B15R1.139 CCCOC(=O)COc1ccc(nc1)Cl 34a_100000744096_200011215008 [0,1,0,0,0,0|1,0,2]=4 1875 B15R1.139 CCCOC(=O)COc1ccc(nc1)Cl 7a_100000744096_200011215008 [0,1,0,0,0,0|1,0,2]=4 1876 B15R1.139 CCCOC(=O)COc1ccc(nc1)F 34a_100000688820_200011215008 [0,1,0,0,0,0|1,0,2]=4 1877 B15R1.139 CCCOC(=O)COc1ccc(nc1)F 7a_100000688820_200011215008 [0,1,0,0,0,0|1,0,2]=4 1878 B15R1.139 CCCOC(=O)COc1ccc(nc1)I 34a_100000687607_200011215008 [0,1,0,0,0,0|1,0,2]=4 1879 B15R1.139 CCCOC(=O)COc1ccc(nc1)I 7a_100000687607_200011215008 [0,1,0,0,0,0|1,0,2]=4 1880 B15R1.139 CCCOC(=O)COc1ccc(nc1)N 34a_100015188713_200011215008 [0,1,0,0,0,0|1,0,2]=4 1881 B15R1.139 CCCOC(=O)COc1ccc(nc1)N 7a_100015188713_200011215008 [0,1,0,0,0,0|1,0,2]=4 1882 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Br 62a_100000752885_200011215008 [0,1,0,0,0,0|0,1,2]=4 1883 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Br 62a_200011215008_100000752885 [0,1,0,0,0,0|0,1,2]=4 1884 B15R1.139 CCCOC(=O)CSc1ccc(cc1)C 62a_100000186775_200011215008 [0,1,0,0,0,0|0,1,2]=4 1885 B15R1.139 CCCOC(=O)CSc1ccc(cc1)C 62a_200011215008_100000186775 [0,1,0,0,0,0|0,1,2]=4 1886 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_200011215008 [0,1,0,0,0,0|0,1,2]=4 1887 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Cl 62a_200011215008_100000755918 [0,1,0,0,0,0|0,1,2]=4 1888 B15R1.139 CCCOC(=O)CSc1ccc(cc1)F 62a_100000211213_200011215008 [0,1,0,0,0,0|0,1,2]=4 1889 B15R1.139 CCCOC(=O)CSc1ccc(cc1)F 62a_200011215008_100000211213 [0,1,0,0,0,0|0,1,2]=4 1890 B15R1.139 CCCOC(=O)CSc1ccc(cc1)N 62a_100000185761_200011215008 [0,1,0,0,0,0|0,1,2]=4 1891 B15R1.139 CCCOC(=O)CSc1ccc(cc1)N 62a_200011215008_100000185761 [0,1,0,0,0,0|0,1,2]=4 1892 B15R1.139 CCCOC(=O)CSc1ccc(cc1)O 62a_200011215008_100000185759 [0,1,0,0,0,0|0,1,2]=4 1893 B15R1.139 COCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000233755 [0,1,0,0,0,0|2,0,1]=4 1894 B15R1.139 COCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000233755 [0,1,0,0,0,0|2,0,1]=4 1895 B15R1.139 COCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000233755 [0,1,0,0,0,0|2,0,1]=4 1896 B15R1.139 COCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000233755 [0,1,0,0,0,0|2,0,1]=4 1897 B15R1.139 COCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000233755 [0,1,0,0,0,0|2,0,1]=4 1898 B15R1.139 COCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000233755 [0,1,0,0,0,0|2,0,1]=4 1899 B15R1.139 CSCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000751147 [0,1,0,0,0,0|2,0,1]=4 1900 B15R1.139 CSCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000751147 [0,1,0,0,0,0|2,0,1]=4 1901 B15R1.139 CSCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000751147 [0,1,0,0,0,0|2,0,1]=4 1902 B15R1.139 CSCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000751147 [0,1,0,0,0,0|2,0,1]=4 1903 B15R1.139 CSCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000751147 [0,1,0,0,0,0|2,0,1]=4 1904 B15R1.139 CSCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000751147 [0,1,0,0,0,0|2,0,1]=4 1905 B15R1.139 Cc1ccc(cc1)OCC(=O)CCC#N 1458a_100000182360_100011215226 [0,1,0,0,0,0|2,0,1]=4 1906 B15R1.139 Cc1ccc(cc1)OCC(=O)CCCF 1458a_100000182360_100011934791 [0,1,0,0,0,0|2,0,1]=4 1907 B15R1.139 Cc1ccc(cc1)OCC(=O)CCCO 1458a_100000182360_100011215043 [0,1,0,0,0,0|2,0,1]=4 1908 B15R1.139 Cc1ccc(cc1)OCC(=O)NCC#N 1626a_100000734998_100000182360 [0,1,0,0,0,0|2,0,1]=4 1909 B15R1.139 Cc1ccc(cc1)OCC(=O)NCC#N 527a_100000734998_100000182360 [0,1,0,0,0,0|2,0,1]=4 1910 B15R1.139 Cc1ccc(cc1)OCC(=O)NCC#N 7a_100000210336_100000736037 [0,1,0,0,0,0|2,0,1]=4 1911 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 11a_100000724931_100000182360 [0,1,0,0,0,0|2,0,1]=4 1912 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 1626a_100000724931_100000182360 [0,1,0,0,0,0|2,0,1]=4 1913 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 240690a_100000724931_100000182360 [0,1,0,0,0,0|2,0,1]=4 1914 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 527a_100000724931_100000182360 [0,1,0,0,0,0|2,0,1]=4 1915 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCO 240690a_100000210304_100000182360 [0,1,0,0,0,0|2,0,1]=4 1916 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCO 527a_100000210304_100000182360 [0,1,0,0,0,0|2,0,1]=4 1917 B15R1.139 Cc1ccc(cc1)OCC(C)OCC=O 34a_100011217472_200009817547 [0,1,0,0,0,0|2,0,1]=4 1918 B15R1.139 Cc1ccc(cc1)OCC(C)OCC=O 7a_100011217472_200015260668 [0,1,0,0,0,0|2,0,1]=4 1919 B15R1.139 N#CCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100011215226 [0,1,0,0,0,0|2,0,1]=4 1920 B15R1.139 N#CCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100011215226 [0,1,0,0,0,0|2,0,1]=4 1921 B15R1.139 N#CCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100011215226 [0,1,0,0,0,0|2,0,1]=4 1922 B15R1.139 N#CCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100011215226 [0,1,0,0,0,0|2,0,1]=4 1923 B15R1.139 N#CCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100011215226 [0,1,0,0,0,0|2,0,1]=4 1924 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Br 1626a_100000734998_100000182358 [0,1,0,0,0,0|2,0,1]=4 1925 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Br 527a_100000734998_100000182358 [0,1,0,0,0,0|2,0,1]=4 1926 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000736037 [0,1,0,0,0,0|2,0,1]=4 1927 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 1626a_100000734998_100016990877 [0,1,0,0,0,0|2,0,1]=4 1928 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 527a_100000734998_100016990877 [0,1,0,0,0,0|2,0,1]=4 1929 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000736037 [0,1,0,0,0,0|2,0,1]=4 1930 B15R1.139 N#CCNC(=O)COc1ccc(cc1)F 1626a_100000734998_100000184765 [0,1,0,0,0,0|2,0,1]=4 1931 B15R1.139 N#CCNC(=O)COc1ccc(cc1)F 527a_100000734998_100000184765 [0,1,0,0,0,0|2,0,1]=4 1932 B15R1.139 N#CCNC(=O)COc1ccc(cc1)I 1626a_100000734998_100000184369 [0,1,0,0,0,0|2,0,1]=4 1933 B15R1.139 N#CCNC(=O)COc1ccc(cc1)I 527a_100000734998_100000184369 [0,1,0,0,0,0|2,0,1]=4 1934 B15R1.139 N#CCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000736037 [0,1,0,0,0,0|2,0,1]=4 1935 B15R1.139 N#CCNC(=O)COc1ccc(cc1)O 527a_100000734998_100000031633 [0,1,0,0,0,0|2,0,1]=4 1936 B15R1.139 O=C(CCCF)COc1ccc(cc1)Br 1458a_100000182358_100011934791 [0,1,0,0,0,0|2,0,1]=4 1937 B15R1.139 O=C(CCCF)COc1ccc(cc1)Cl 1458a_100016990877_100011934791 [0,1,0,0,0,0|2,0,1]=4 1938 B15R1.139 O=C(CCCF)COc1ccc(cc1)F 1458a_100000184765_100011934791 [0,1,0,0,0,0|2,0,1]=4 1939 B15R1.139 O=C(CCCF)COc1ccc(cc1)I 1458a_100000184369_100011934791 [0,1,0,0,0,0|2,0,1]=4 1940 B15R1.139 O=C(CCCF)COc1ccc(cc1)O 1458a_100000031633_100011934791 [0,1,0,0,0,0|2,0,1]=4 1941 B15R1.139 O=C(CCCO)COc1ccc(cc1)Br 1458a_100000182358_100011215043 [0,1,0,0,0,0|2,0,1]=4 1942 B15R1.139 O=C(CCCO)COc1ccc(cc1)Cl 1458a_100016990877_100011215043 [0,1,0,0,0,0|2,0,1]=4 1943 B15R1.139 O=C(CCCO)COc1ccc(cc1)F 1458a_100000184765_100011215043 [0,1,0,0,0,0|2,0,1]=4 1944 B15R1.139 O=C(CCCO)COc1ccc(cc1)I 1458a_100000184369_100011215043 [0,1,0,0,0,0|2,0,1]=4 1945 B15R1.139 O=C(CCCO)COc1ccc(cc1)O 1458a_100000031633_100011215043 [0,1,0,0,0,0|2,0,1]=4 1946 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 11a_100000724931_100000182358 [0,1,0,0,0,0|2,0,1]=4 1947 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 1626a_100000724931_100000182358 [0,1,0,0,0,0|2,0,1]=4 1948 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 240690a_100000724931_100000182358 [0,1,0,0,0,0|2,0,1]=4 1949 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 527a_100000724931_100000182358 [0,1,0,0,0,0|2,0,1]=4 1950 B15R1.139 O=C(COc1ccc(cc1)Br)NCCO 240690a_100000210304_100000182358 [0,1,0,0,0,0|2,0,1]=4 1951 B15R1.139 O=C(COc1ccc(cc1)Br)NCCO 527a_100000210304_100000182358 [0,1,0,0,0,0|2,0,1]=4 1952 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 11a_100000724931_100016990877 [0,1,0,0,0,0|2,0,1]=4 1953 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 1626a_100000724931_100016990877 [0,1,0,0,0,0|2,0,1]=4 1954 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 240690a_100000724931_100016990877 [0,1,0,0,0,0|2,0,1]=4 1955 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 527a_100000724931_100016990877 [0,1,0,0,0,0|2,0,1]=4 1956 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCO 240690a_100000210304_100016990877 [0,1,0,0,0,0|2,0,1]=4 1957 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCO 527a_100000210304_100016990877 [0,1,0,0,0,0|2,0,1]=4 1958 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 11a_100000724931_100000184765 [0,1,0,0,0,0|2,0,1]=4 1959 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 1626a_100000724931_100000184765 [0,1,0,0,0,0|2,0,1]=4 1960 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 240690a_100000724931_100000184765 [0,1,0,0,0,0|2,0,1]=4 1961 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 527a_100000724931_100000184765 [0,1,0,0,0,0|2,0,1]=4 1962 B15R1.139 O=C(COc1ccc(cc1)F)NCCO 240690a_100000210304_100000184765 [0,1,0,0,0,0|2,0,1]=4 1963 B15R1.139 O=C(COc1ccc(cc1)F)NCCO 527a_100000210304_100000184765 [0,1,0,0,0,0|2,0,1]=4 1964 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 11a_100000724931_100000184369 [0,1,0,0,0,0|2,0,1]=4 1965 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 1626a_100000724931_100000184369 [0,1,0,0,0,0|2,0,1]=4 1966 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 240690a_100000724931_100000184369 [0,1,0,0,0,0|2,0,1]=4 1967 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 527a_100000724931_100000184369 [0,1,0,0,0,0|2,0,1]=4 1968 B15R1.139 O=C(COc1ccc(cc1)I)NCCO 240690a_100000210304_100000184369 [0,1,0,0,0,0|2,0,1]=4 1969 B15R1.139 O=C(COc1ccc(cc1)I)NCCO 527a_100000210304_100000184369 [0,1,0,0,0,0|2,0,1]=4 1970 B15R1.139 O=C(COc1ccc(cc1)O)NCCF 240690a_100000724931_100000031633 [0,1,0,0,0,0|2,0,1]=4 1971 B15R1.139 O=C(COc1ccc(cc1)O)NCCF 527a_100000724931_100000031633 [0,1,0,0,0,0|2,0,1]=4 1972 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 240690a_100000210304_100000031633 [0,1,0,0,0,0|2,0,1]=4 1973 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 271570a_203496583355_200000158804 [0,1,0,0,0,0|2,0,1]=4 1974 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 527a_100000210304_100000031633 [0,1,0,0,0,0|2,0,1]=4 1975 B15R1.551 C#CCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000753159 [0,1,0,0,0,0|1,0,2]=4 1976 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 11a_100000212058_100000188414 [0,1,0,0,0,0|1,0,2]=4 1977 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 1626a_100000212058_100000188414 [0,1,0,0,0,0|1,0,2]=4 1978 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 240690a_100000212058_100000188414 [0,1,0,0,0,0|1,0,2]=4 1979 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000735948 [0,1,0,0,0,0|1,0,2]=4 1980 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 527a_100000212058_100000188414 [0,1,0,0,0,0|1,0,2]=4 1981 B15R1.551 C#CCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000735948 [0,1,0,0,0,0|1,0,2]=4 1982 B15R1.551 C/C=C/CC(=O)C(C)Oc1ccccc1 1458a_100000188414_100102629194 [0,1,0,0,0,0|1,0,2]=4 1983 B15R1.551 C=CC=CC(=O)C(C)Cc1ccccc1 1458a_100016291481_200011218536 [0,1,0,0,0,0|2,0,1]=4 1984 B15R1.551 C=CCCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000754431 [0,1,0,0,0,0|2,0,1]=4 1985 B15R1.551 C=CCCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000754431 [0,1,0,0,0,0|2,0,1]=4 1986 B15R1.551 C=CCCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000754431 [0,1,0,0,0,0|2,0,1]=4 1987 B15R1.551 C=CCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000754431 [0,1,0,0,0,0|2,0,1]=4 1988 B15R1.551 C=CCCC(=O)C(C)Cc1ccccc1 1458a_100000749702_200011218536 [0,1,0,0,0,0|2,0,0]=3 1989 B15R1.551 C=CCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000754431 [0,1,0,0,0,0|2,0,0]=3 1990 B15R1.551 C=CCCC(=O)C(C)Cc1ccccn1 1458a_100012000792_100000754431 [0,1,0,0,0,0|3,0,0]=4 1991 B15R1.551 C=CCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000754431 [0,1,0,0,0,0|1,0,0]=2 1992 B15R1.551 C=CCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000754431 [0,1,0,0,0,0|1,1,0]=3 1993 B15R1.551 C=CCCC(=O)C(C)Sc1ccccn1 1458a_100000156770_100000754431 [0,1,0,0,0,0|2,1,0]=4 1994 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000749702 [0,1,0,0,0,0|3,0,0]=4 1995 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000749702 [0,1,0,0,0,0|3,0,0]=4 1996 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000749702 [0,1,0,0,0,0|3,0,0]=4 1997 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000749702 [0,1,0,0,0,0|3,0,0]=4 1998 B15R1.551 C=CCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000754431 [0,1,0,0,0,0|2,0,0]=3 1999 B15R1.551 C=CCNC(=O)/C(=C/c1ccccc1)/C 1626a_100020586998_100016990649 [0,1,0,0,0,0|2,0,1]=4 2000 B15R1.551 C=CCNC(=O)/C(=C/c1ccccc1)/C 527a_100020586998_100016990649 [0,1,0,0,0,0|2,0,1]=4 2001 B15R1.551 C=CCNC(=O)/C(=C/c1ccccc1)/Cl 1626a_100020586998_200020598536 [0,1,0,0,0,0|2,0,1]=4 2002 B15R1.551 C=CCNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100020586998_200020598536 [0,1,0,0,0,0|2,0,1]=4 2003 B15R1.551 C=CCNC(=O)/C(=C/c1ccccc1)/Cl 527a_100020586998_200020598536 [0,1,0,0,0,0|2,0,1]=4 2004 B15R1.551 C=CCNC(=O)/C(=C\c1ccccc1)/F 527a_100020586998_100020889036 [0,1,0,0,0,0|2,0,1]=4 2005 B15R1.551 C=CCNC(=O)C(=C)Cc1ccccc1 1626a_100020586998_100000066491 [0,1,0,0,0,0|2,0,1]=4 2006 B15R1.551 C=CCNC(=O)C(=O)Nc1ccccc1 240690a_100020586998_100000738435 [0,1,0,0,0,0|2,0,1]=4 2007 B15R1.551 C=CCNC(=O)C(C)Cc1ccccc1 1626a_100020586998_100000754839 [0,1,0,0,0,0|2,0,0]=3 2008 B15R1.551 C=CCNC(=O)C(C)Cc1ccccc1 240690a_100020586998_100000754839 [0,1,0,0,0,0|2,0,0]=3 2009 B15R1.551 C=CCNC(=O)C(C)Cc1ccccc1 527a_100020586998_100000754839 [0,1,0,0,0,0|2,0,0]=3 2010 B15R1.551 C=CCNC(=O)C(C)Cc1ccccn1 1626a_100020586998_100012000792 [0,1,0,0,0,0|3,0,0]=4 2011 B15R1.551 C=CCNC(=O)C(C)Cc1ccccn1 240690a_100020586998_100012000792 [0,1,0,0,0,0|3,0,0]=4 2012 B15R1.551 C=CCNC(=O)C(C)Cc1ccccn1 527a_100020586998_100012000792 [0,1,0,0,0,0|3,0,0]=4 2013 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 1626a_100020586998_100000188414 [0,1,0,0,0,0|1,0,0]=2 2014 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 240690a_100020586998_100000188414 [0,1,0,0,0,0|1,0,0]=2 2015 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 527a_100020586998_100000188414 [0,1,0,0,0,0|1,0,0]=2 2016 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000230288 [0,1,0,0,0,0|1,0,0]=2 2017 B15R1.551 C=CCNC(=O)C(C)Oc1cccnc1 7a_100000210849_100000230288 [0,1,0,0,0,0|2,0,0]=3 2018 B15R1.551 C=CCNC(=O)C(C)Oc1cncnc1 7a_100000754086_100000230288 [0,1,0,0,0,0|3,0,0]=4 2019 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 1626a_100020586998_100000199063 [0,1,0,0,0,0|1,1,0]=3 2020 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 240690a_100020586998_100000199063 [0,1,0,0,0,0|1,1,0]=3 2021 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 527a_100020586998_100000199063 [0,1,0,0,0,0|1,1,0]=3 2022 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 62a_100000230288_100000041952 [0,1,0,0,0,0|1,1,0]=3 2023 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000230288 [0,1,0,0,0,0|1,1,0]=3 2024 B15R1.551 C=CCNC(=O)C(C)Sc1ccccn1 1626a_100020586998_100000156770 [0,1,0,0,0,0|2,1,0]=4 2025 B15R1.551 C=CCNC(=O)C(C)Sc1ccccn1 240690a_100020586998_100000156770 [0,1,0,0,0,0|2,1,0]=4 2026 B15R1.551 C=CCNC(=O)C(C)Sc1ccccn1 527a_100020586998_100000156770 [0,1,0,0,0,0|2,1,0]=4 2027 B15R1.551 C=CCNC(=O)C(C)Sc1ccccn1 62a_100000230288_100011216584 [0,1,0,0,0,0|2,1,0]=4 2028 B15R1.551 C=CCNC(=O)C(C)Sc1ccccn1 62a_100011216584_100000230288 [0,1,0,0,0,0|2,1,0]=4 2029 B15R1.551 C=CCNC(=O)C(C)Sc1cccnc1 62a_100000210063_100000230288 [0,1,0,0,0,0|2,1,0]=4 2030 B15R1.551 C=CCNC(=O)C(C)Sc1cccnc1 62a_100000230288_100000210063 [0,1,0,0,0,0|2,1,0]=4 2031 B15R1.551 C=CCNC(=O)C(C)Sc1ccncc1 62a_100000230288_100000728582 [0,1,0,0,0,0|2,1,0]=4 2032 B15R1.551 C=CCNC(=O)C(C)Sc1ccncc1 62a_100000728582_100000230288 [0,1,0,0,0,0|2,1,0]=4 2033 B15R1.551 C=CCNC(=O)N(C)Cc1ccccc1 273464a_100020586998_100000186898 [0,1,0,0,0,0|3,0,0]=4 2034 B15R1.551 C=CCNC(=O)[C@H](O)Cc1ccccc1 240690a_100020586998_100009816399 [0,1,0,0,0,0|2,0,0]=3 2035 B15R1.551 C=CCNC(C)C(C)Oc1ccccc1 270004a_100020586998_100000150574 [0,1,0,0,0,0|2,0,1]=4 2036 B15R1.551 CC(Oc1ccccc1)C(=O)CCC#N 1458a_100000188414_100011215226 [0,1,0,0,0,0|2,0,1]=4 2037 B15R1.551 CC(Oc1ccccc1)C(=O)CCCF 1458a_100000188414_100011934791 [0,1,0,0,0,0|2,0,1]=4 2038 B15R1.551 CC(Oc1ccccc1)C(=O)CCCO 1458a_100000188414_100011215043 [0,1,0,0,0,0|2,0,1]=4 2039 B15R1.551 CC(Oc1ccccc1)C(=O)NCC#N 1626a_100000734998_100000188414 [0,1,0,0,0,0|2,0,1]=4 2040 B15R1.551 CC(Oc1ccccc1)C(=O)NCC#N 527a_100000734998_100000188414 [0,1,0,0,0,0|2,0,1]=4 2041 B15R1.551 CC(Oc1ccccc1)C(=O)NCCF 11a_100000724931_100000188414 [0,1,0,0,0,0|2,0,1]=4 2042 B15R1.551 CC(Oc1ccccc1)C(=O)NCCF 1626a_100000724931_100000188414 [0,1,0,0,0,0|2,0,1]=4 2043 B15R1.551 CC(Oc1ccccc1)C(=O)NCCF 240690a_100000724931_100000188414 [0,1,0,0,0,0|2,0,1]=4 2044 B15R1.551 CC(Oc1ccccc1)C(=O)NCCF 527a_100000724931_100000188414 [0,1,0,0,0,0|2,0,1]=4 2045 B15R1.551 CC(Oc1ccccc1)C(=O)NCCO 240690a_100000210304_100000188414 [0,1,0,0,0,0|2,0,1]=4 2046 B15R1.551 CC(Oc1ccccc1)C(=O)NCCO 527a_100000210304_100000188414 [0,1,0,0,0,0|2,0,1]=4 2047 B15R1.551 CC=CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000070051 [0,1,0,0,0,0|1,0,2]=4 2048 B15R1.551 CC=NNC(=O)C(C)Oc1ccccc1 4a_200000188956_200000210099 [0,1,0,0,0,0|2,0,1]=4 2049 B15R1.551 CCCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210211 [0,1,0,0,0,0|1,0,2]=4 2050 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 11a_100020643023_100000188414 [0,1,0,0,0,0|1,0,2]=4 2051 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 1626a_100020643023_100000188414 [0,1,0,0,0,0|1,0,2]=4 2052 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 240690a_100020643023_100000188414 [0,1,0,0,0,0|1,0,2]=4 2053 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000230305 [0,1,0,0,0,0|1,0,2]=4 2054 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 527a_100020643023_100000188414 [0,1,0,0,0,0|1,0,2]=4 2055 B15R1.551 CCCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000230305 [0,1,0,0,0,0|1,0,2]=4 2056 B15R1.551 CCCOC(=O)C(C)Nc1ccccc1 34a_100000106764_100000760410 [0,1,0,0,0,0|1,0,2]=4 2057 B15R1.551 CCCOC(=O)C(C)Oc1ccccc1 34a_100000210340_100000760410 [0,1,0,0,0,0|0,0,2]=3 2058 B15R1.551 CCCOC(=O)C(C)Oc1ccccc1 7a_100000210340_100000760410 [0,1,0,0,0,0|0,0,2]=3 2059 B15R1.551 CCCOC(=O)C(C)Oc1cccnc1 34a_100000210849_100000760410 [0,1,0,0,0,0|1,0,2]=4 2060 B15R1.551 CCCOC(=O)C(C)Oc1cccnc1 7a_100000210849_100000760410 [0,1,0,0,0,0|1,0,2]=4 2061 B15R1.551 CCCOC(=O)C(C)Oc1ccncc1 34a_100000212176_100000760410 [0,1,0,0,0,0|1,0,2]=4 2062 B15R1.551 CCCOC(=O)C(C)Sc1ccccc1 62a_100000719477_100000760410 [0,1,0,0,0,0|0,1,2]=4 2063 B15R1.551 CCCOC(=O)C(C)Sc1ccccc1 62a_100000760410_100000041952 [0,1,0,0,0,0|0,1,2]=4 2064 B15R1.551 COCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000233755 [0,1,0,0,0,0|2,0,1]=4 2065 B15R1.551 CSCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000751147 [0,1,0,0,0,0|2,0,1]=4 2066 B15R1.741 C#CC(C)NC(=O)COc1ccccc1 11a_100000707721_100000186222 [0,1,0,0,0,0|1,0,2]=4 2067 B15R1.741 C#CC(C)NC(=O)COc1ccccc1 1626a_100000707721_100000186222 [0,1,0,0,0,0|1,0,2]=4 2068 B15R1.741 C#CC(C)NC(=O)COc1ccccc1 240690a_100000707721_100000186222 [0,1,0,0,0,0|1,0,2]=4 2069 B15R1.741 C#CC(C)NC(=O)COc1ccccc1 527a_100000707721_100000186222 [0,1,0,0,0,0|1,0,2]=4 2070 B15R1.741 C=CC(=O)CC(=O)CCc1ccccc1 1458a_100000185746_100012361361 [0,1,0,0,0,0|2,0,1]=4 2071 B15R1.741 C=CC(C)CC(=O)CCc1ccccc1 1458a_100011934298_100000765856 [0,1,0,0,0,0|2,0,0]=3 2072 B15R1.741 C=CC(C)CC(=O)CCc1ccccn1 1458a_100011934298_100015183660 [0,1,0,0,0,0|3,0,0]=4 2073 B15R1.741 C=CC(C)CC(=O)CCc1cccnc1 1458a_100011934298_200011713674 [0,1,0,0,0,0|3,0,0]=4 2074 B15R1.741 C=CC(C)CC(=O)CCc1ccncc1 1458a_100011934298_100000723409 [0,1,0,0,0,0|3,0,0]=4 2075 B15R1.741 C=CC(C)CC(=O)NCc1ccccc1 11a_100015324214_100011934298 [0,1,0,0,0,0|3,0,0]=4 2076 B15R1.741 C=CC(C)CC(=O)NCc1ccccc1 1626a_100015324214_100011934298 [0,1,0,0,0,0|3,0,0]=4 2077 B15R1.741 C=CC(C)CC(=O)NCc1ccccc1 240690a_100015324214_100011934298 [0,1,0,0,0,0|3,0,0]=4 2078 B15R1.741 C=CC(C)CC(=O)NCc1ccccc1 527a_100015324214_100011934298 [0,1,0,0,0,0|3,0,0]=4 2079 B15R1.741 C=CC(C)CC(=O)NNc1ccccc1 22a_100015195140_100011934298 [0,1,0,0,0,0|3,0,0]=4 2080 B15R1.741 CC(C#N)NC(=O)COc1ccccc1 11a_100000737613_100000186222 [0,1,0,0,0,0|2,0,1]=4 2081 B15R1.741 CC(C#N)NC(=O)COc1ccccc1 1626a_100000737613_100000186222 [0,1,0,0,0,0|2,0,1]=4 2082 B15R1.741 CC(C#N)NC(=O)COc1ccccc1 527a_100000737613_100000186222 [0,1,0,0,0,0|2,0,1]=4 2083 B15R1.741 CCC(C)CC(=O)COc1ccccc1 1458a_100000186222_100000748023 [0,1,0,0,0,0|1,0,2]=4 2084 B15R1.741 CCC(C)NC(=O)COc1ccccc1 11a_100000209981_100000186222 [0,1,0,0,0,0|1,0,2]=4 2085 B15R1.741 CCC(C)NC(=O)COc1ccccc1 1626a_100000209981_100000186222 [0,1,0,0,0,0|1,0,2]=4 2086 B15R1.741 CCC(C)NC(=O)COc1ccccc1 240690a_100000209981_100000186222 [0,1,0,0,0,0|1,0,2]=4 2087 B15R1.741 CCC(C)NC(=O)COc1ccccc1 34a_100000210340_100000182745 [0,1,0,0,0,0|1,0,2]=4 2088 B15R1.741 CCC(C)NC(=O)COc1ccccc1 527a_100000209981_100000186222 [0,1,0,0,0,0|1,0,2]=4 2089 B15R1.741 CCC(C)NC(=O)COc1ccccc1 7a_100000210340_100000182745 [0,1,0,0,0,0|1,0,2]=4 2090 B15R1.741 CCC(O)CC(=O)COc1ccccc1 1458a_100000186222_100011218378 [0,1,0,0,0,0|1,0,2]=4 2091 B15R1.741 CC[C@H](C)CC(=O)COc1ccccc1 1458a_100000186222_100009816398 [0,1,0,0,0,0|1,0,2]=4 2092 B15R1.741 C[C@@H](CO)CC(=O)COc1ccccc1 1458a_100000186222_100000059175 [0,1,0,0,0,0|2,0,1]=4 2093 B15R1.741 C[C@H](CF)NC(=O)COc1ccccc1 11a_100102880703_100000186222 [0,1,0,0,0,0|2,0,1]=4 2094 B15R1.741 C[C@H](CF)NC(=O)COc1ccccc1 1626a_100102880703_100000186222 [0,1,0,0,0,0|2,0,1]=4 2095 B15R1.741 C[C@H](CF)NC(=O)COc1ccccc1 240690a_100102880703_100000186222 [0,1,0,0,0,0|2,0,1]=4 2096 B15R1.741 C[C@H](CF)NC(=O)COc1ccccc1 527a_100102880703_100000186222 [0,1,0,0,0,0|2,0,1]=4 2097 B15R1.741 C[C@H](CO)NC(=O)COc1ccccc1 240690a_100000737577_100000186222 [0,1,0,0,0,0|2,0,1]=4 2098 B15R1.741 C[C@H](CO)NC(=O)COc1ccccc1 527a_100000737577_100000186222 [0,1,0,0,0,0|2,0,1]=4 2099 B15R1.826 C#CCN(C)C(=O)COc1ccccc1 11a_100000225692_100000186222 [0,1,0,0,0,0|1,0,2]=4 2100 B15R1.826 C#CCN(C)C(=O)COc1ccccc1 1626a_100000225692_100000186222 [0,1,0,0,0,0|1,0,2]=4 2101 B15R1.826 C#CCN(C)C(=O)COc1ccccc1 527a_100000225692_100000186222 [0,1,0,0,0,0|1,0,2]=4 2102 B15R1.826 C=CCC(C)C(=O)CCc1ccccc1 1458a_100011216819_100000765856 [0,1,0,0,0,0|2,0,0]=3 2103 B15R1.826 C=CCC(C)C(=O)CCc1ccccn1 1458a_100011216819_100015183660 [0,1,0,0,0,0|3,0,0]=4 2104 B15R1.826 C=CCC(C)C(=O)CCc1cccnc1 1458a_100011216819_200011713674 [0,1,0,0,0,0|3,0,0]=4 2105 B15R1.826 C=CCC(C)C(=O)CCc1ccncc1 1458a_100011216819_100000723409 [0,1,0,0,0,0|3,0,0]=4 2106 B15R1.826 C=CCC(C)C(=O)NCc1ccccc1 11a_100015324214_100011216819 [0,1,0,0,0,0|3,0,0]=4 2107 B15R1.826 C=CCC(C)C(=O)NCc1ccccc1 1626a_100015324214_100011216819 [0,1,0,0,0,0|3,0,0]=4 2108 B15R1.826 C=CCC(C)C(=O)NCc1ccccc1 240690a_100015324214_100011216819 [0,1,0,0,0,0|3,0,0]=4 2109 B15R1.826 C=CCC(C)C(=O)NCc1ccccc1 527a_100015324214_100011216819 [0,1,0,0,0,0|3,0,0]=4 2110 B15R1.826 C=CCC(C)C(=O)NNc1ccccc1 22a_100015195140_100011216819 [0,1,0,0,0,0|3,0,0]=4 2111 B15R1.826 C=CCN(C)C(=O)C#Cc1ccccc1 240690a_100000225617_100000736102 [0,1,0,0,0,0|2,0,1]=4 2112 B15R1.826 C=CCN(C)C(=O)C=Cc1ccccc1 11a_100000225617_100000210462 [0,1,0,0,0,0|2,0,1]=4 2113 B15R1.826 C=CCN(C)C(=O)C=Cc1ccccc1 1626a_100000225617_100000210462 [0,1,0,0,0,0|2,0,1]=4 2114 B15R1.826 C=CCN(C)C(=O)CCc1ccccc1 11a_100000225617_100000185753 [0,1,0,0,0,0|2,0,0]=3 2115 B15R1.826 C=CCN(C)C(=O)CCc1ccccc1 1626a_100000225617_100000185753 [0,1,0,0,0,0|2,0,0]=3 2116 B15R1.826 C=CCN(C)C(=O)CCc1ccccc1 240690a_100000225617_100000185753 [0,1,0,0,0,0|2,0,0]=3 2117 B15R1.826 C=CCN(C)C(=O)CCc1ccccc1 527a_100000225617_100000185753 [0,1,0,0,0,0|2,0,0]=3 2118 B15R1.826 C=CCN(C)C(=O)CCc1ccccn1 11a_100000225617_100015195070 [0,1,0,0,0,0|3,0,0]=4 2119 B15R1.826 C=CCN(C)C(=O)CCc1ccccn1 240690a_100000225617_100015195070 [0,1,0,0,0,0|3,0,0]=4 2120 B15R1.826 C=CCN(C)C(=O)CCc1ccccn1 527a_100000225617_100015195070 [0,1,0,0,0,0|3,0,0]=4 2121 B15R1.826 C=CCN(C)C(=O)CCc1cccnc1 11a_100000225617_100000198484 [0,1,0,0,0,0|3,0,0]=4 2122 B15R1.826 C=CCN(C)C(=O)CCc1cccnc1 1626a_100000225617_100000198484 [0,1,0,0,0,0|3,0,0]=4 2123 B15R1.826 C=CCN(C)C(=O)CCc1cccnc1 240690a_100000225617_100000198484 [0,1,0,0,0,0|3,0,0]=4 2124 B15R1.826 C=CCN(C)C(=O)CCc1cccnc1 527a_100000225617_100000198484 [0,1,0,0,0,0|3,0,0]=4 2125 B15R1.826 C=CCN(C)C(=O)CCc1ccncc1 11a_100000225617_100011225043 [0,1,0,0,0,0|3,0,0]=4 2126 B15R1.826 C=CCN(C)C(=O)CCc1ccncc1 240690a_100000225617_100011225043 [0,1,0,0,0,0|3,0,0]=4 2127 B15R1.826 C=CCN(C)C(=O)CCc1ccncc1 527a_100000225617_100011225043 [0,1,0,0,0,0|3,0,0]=4 2128 B15R1.826 C=CCN(C)C(=O)COc1ccccc1 11a_100000225617_100000186222 [0,1,0,0,0,0|1,0,0]=2 2129 B15R1.826 C=CCN(C)C(=O)COc1ccccc1 1626a_100000225617_100000186222 [0,1,0,0,0,0|1,0,0]=2 2130 B15R1.826 C=CCN(C)C(=O)COc1ccccc1 240690a_100000225617_100000186222 [0,1,0,0,0,0|1,0,0]=2 2131 B15R1.826 C=CCN(C)C(=O)COc1ccccc1 527a_100000225617_100000186222 [0,1,0,0,0,0|1,0,0]=2 2132 B15R1.826 C=CCN(C)C(=O)COc1ccccn1 1626a_100000225617_100102699861 [0,1,0,0,0,0|2,0,0]=3 2133 B15R1.826 C=CCN(C)C(=O)COc1ccccn1 240690a_100000225617_100102699861 [0,1,0,0,0,0|2,0,0]=3 2134 B15R1.826 C=CCN(C)C(=O)COc1ccccn1 527a_100000225617_100102699861 [0,1,0,0,0,0|2,0,0]=3 2135 B15R1.826 C=CCN(C)C(=O)COc1cccnc1 11a_100000225617_100015207166 [0,1,0,0,0,0|2,0,0]=3 2136 B15R1.826 C=CCN(C)C(=O)COc1cccnc1 1626a_100000225617_100015207166 [0,1,0,0,0,0|2,0,0]=3 2137 B15R1.826 C=CCN(C)C(=O)COc1cccnc1 240690a_100000225617_100015207166 [0,1,0,0,0,0|2,0,0]=3 2138 B15R1.826 C=CCN(C)C(=O)COc1cccnc1 527a_100000225617_100015207166 [0,1,0,0,0,0|2,0,0]=3 2139 B15R1.826 C=CCN(C)C(=O)CSc1ccccc1 11a_100000225617_100000211596 [0,1,0,0,0,0|1,1,0]=3 2140 B15R1.826 C=CCN(C)C(=O)CSc1ccccc1 1626a_100000225617_100000211596 [0,1,0,0,0,0|1,1,0]=3 2141 B15R1.826 C=CCN(C)C(=O)CSc1ccccc1 240690a_100000225617_100000211596 [0,1,0,0,0,0|1,1,0]=3 2142 B15R1.826 C=CCN(C)C(=O)CSc1ccccc1 527a_100000225617_100000211596 [0,1,0,0,0,0|1,1,0]=3 2143 B15R1.826 C=CCN(C)C(=O)CSc1ccccn1 11a_100000225617_100000156281 [0,1,0,0,0,0|2,1,0]=4 2144 B15R1.826 C=CCN(C)C(=O)CSc1ccccn1 240690a_100000225617_100000156281 [0,1,0,0,0,0|2,1,0]=4 2145 B15R1.826 C=CCN(C)C(=O)CSc1ccccn1 527a_100000225617_100000156281 [0,1,0,0,0,0|2,1,0]=4 2146 B15R1.826 C=CCN(C)C(=O)CSc1ccncc1 11a_100000225617_100000211328 [0,1,0,0,0,0|2,1,0]=4 2147 B15R1.826 C=CCN(C)C(=O)CSc1ccncc1 1626a_100000225617_100000211328 [0,1,0,0,0,0|2,1,0]=4 2148 B15R1.826 C=CCN(C)C(=O)CSc1ccncc1 240690a_100000225617_100000211328 [0,1,0,0,0,0|2,1,0]=4 2149 B15R1.826 C=CCN(C)C(=O)CSc1ccncc1 527a_100000225617_100000211328 [0,1,0,0,0,0|2,1,0]=4 2150 B15R1.826 C=CCN(C)C(=O)NCc1ccccc1 2708a_100015324214_100000225617 [0,1,0,0,0,0|3,0,0]=4 2151 B15R1.826 C=CCN(C)C(=O)NCc1ccccc1 273464a_100015324214_100000225617 [0,1,0,0,0,0|3,0,0]=4 2152 B15R1.826 C=CCN(C)C(C)COc1ccccc1 270004a_100000225617_100000150576 [0,1,0,0,0,0|2,0,1]=4 2153 B15R1.826 CC(CC#N)C(=O)COc1ccccc1 1458a_100000186222_100009813641 [0,1,0,0,0,0|2,0,1]=4 2154 B15R1.826 CC(CCO)C(=O)COc1ccccc1 1458a_100000186222_100009893172 [0,1,0,0,0,0|2,0,1]=4 2155 B15R1.826 CCCC(C)C(=O)COc1ccccc1 1458a_100000186222_100000766640 [0,1,0,0,0,0|1,0,2]=4 2156 B15R1.826 CCCN(C)C(=O)COc1ccccc1 11a_100000747261_100000186222 [0,1,0,0,0,0|1,0,2]=4 2157 B15R1.826 CCCN(C)C(=O)COc1ccccc1 1626a_100000747261_100000186222 [0,1,0,0,0,0|1,0,2]=4 2158 B15R1.826 CCCN(C)C(=O)COc1ccccc1 240690a_100000747261_100000186222 [0,1,0,0,0,0|1,0,2]=4 2159 B15R1.826 CCCN(C)C(=O)COc1ccccc1 527a_100000747261_100000186222 [0,1,0,0,0,0|1,0,2]=4 2160 B15R1.826 CN(CC#N)C(=O)COc1ccccc1 11a_100000748184_100000186222 [0,1,0,0,0,0|2,0,1]=4 2161 B15R1.826 CN(CC#N)C(=O)COc1ccccc1 1626a_100000748184_100000186222 [0,1,0,0,0,0|2,0,1]=4 2162 B15R1.826 CN(CCO)C(=O)COc1ccccc1 240690a_100000210263_100000186222 [0,1,0,0,0,0|2,0,1]=4 2163 B15R1.826 CN(CCO)C(=O)COc1ccccc1 527a_100000210263_100000186222 [0,1,0,0,0,0|2,0,1]=4 2164 B15R1.826 COCC(C)C(=O)COc1ccccc1 1458a_100000186222_100000765312 [0,1,0,0,0,0|2,0,1]=4 2165 B15R1.1208 C#CCCC(=O)COc1ccccc1Br 1458a_100000216496_100000753159 [0,1,0,0,0,0|1,0,2]=4 2166 B15R1.1208 C#CCCC(=O)COc1ccccc1C 1458a_100000182418_100000753159 [0,1,0,0,0,0|1,0,2]=4 2167 B15R1.1208 C#CCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000753159 [0,1,0,0,0,0|1,0,2]=4 2168 B15R1.1208 C#CCCC(=O)COc1ccccc1F 1458a_100000182486_100000753159 [0,1,0,0,0,0|1,0,2]=4 2169 B15R1.1208 C#CCCC(=O)COc1ccccc1O 1458a_100000183020_100000753159 [0,1,0,0,0,0|1,0,2]=4 2170 B15R1.1208 C#CCNC(=O)COc1ccccc1Br 11a_100000212058_100000216496 [0,1,0,0,0,0|1,0,2]=4 2171 B15R1.1208 C#CCNC(=O)COc1ccccc1Br 1626a_100000212058_100000216496 [0,1,0,0,0,0|1,0,2]=4 2172 B15R1.1208 C#CCNC(=O)COc1ccccc1Br 240690a_100000212058_100000216496 [0,1,0,0,0,0|1,0,2]=4 2173 B15R1.1208 C#CCNC(=O)COc1ccccc1Br 527a_100000212058_100000216496 [0,1,0,0,0,0|1,0,2]=4 2174 B15R1.1208 C#CCNC(=O)COc1ccccc1C 11a_100000212058_100000182418 [0,1,0,0,0,0|1,0,2]=4 2175 B15R1.1208 C#CCNC(=O)COc1ccccc1C 1626a_100000212058_100000182418 [0,1,0,0,0,0|1,0,2]=4 2176 B15R1.1208 C#CCNC(=O)COc1ccccc1C 240690a_100000212058_100000182418 [0,1,0,0,0,0|1,0,2]=4 2177 B15R1.1208 C#CCNC(=O)COc1ccccc1C 527a_100000212058_100000182418 [0,1,0,0,0,0|1,0,2]=4 2178 B15R1.1208 C#CCNC(=O)COc1ccccc1Cl 11a_100000212058_100000185159 [0,1,0,0,0,0|1,0,2]=4 2179 B15R1.1208 C#CCNC(=O)COc1ccccc1Cl 1626a_100000212058_100000185159 [0,1,0,0,0,0|1,0,2]=4 2180 B15R1.1208 C#CCNC(=O)COc1ccccc1Cl 240690a_100000212058_100000185159 [0,1,0,0,0,0|1,0,2]=4 2181 B15R1.1208 C#CCNC(=O)COc1ccccc1Cl 527a_100000212058_100000185159 [0,1,0,0,0,0|1,0,2]=4 2182 B15R1.1208 C#CCNC(=O)COc1ccccc1F 11a_100000212058_100000182486 [0,1,0,0,0,0|1,0,2]=4 2183 B15R1.1208 C#CCNC(=O)COc1ccccc1F 1626a_100000212058_100000182486 [0,1,0,0,0,0|1,0,2]=4 2184 B15R1.1208 C#CCNC(=O)COc1ccccc1F 240690a_100000212058_100000182486 [0,1,0,0,0,0|1,0,2]=4 2185 B15R1.1208 C#CCNC(=O)COc1ccccc1F 527a_100000212058_100000182486 [0,1,0,0,0,0|1,0,2]=4 2186 B15R1.1208 C#CCNC(=O)COc1ccccc1O 240690a_100000212058_100000183020 [0,1,0,0,0,0|1,0,2]=4 2187 B15R1.1208 C#CCNC(=O)COc1ccccc1O 527a_100000212058_100000183020 [0,1,0,0,0,0|1,0,2]=4 2188 B15R1.1208 C/C=C/CC(=O)COc1ccccc1Br 1458a_100000216496_100102629194 [0,1,0,0,0,0|1,0,2]=4 2189 B15R1.1208 C/C=C/CC(=O)COc1ccccc1C 1458a_100000182418_100102629194 [0,1,0,0,0,0|1,0,2]=4 2190 B15R1.1208 C/C=C/CC(=O)COc1ccccc1Cl 1458a_100000185159_100102629194 [0,1,0,0,0,0|1,0,2]=4 2191 B15R1.1208 C/C=C/CC(=O)COc1ccccc1F 1458a_100000182486_100102629194 [0,1,0,0,0,0|1,0,2]=4 2192 B15R1.1208 C/C=C/CC(=O)COc1ccccc1O 1458a_100000183020_100102629194 [0,1,0,0,0,0|1,0,2]=4 2193 B15R1.1208 C=C(COc1ccccc1Br)OCOC 34a_100000181306_100000042856 [0,1,0,0,0,0|2,0,1]=4 2194 B15R1.1208 C=C(COc1ccccc1C)OCOC 34a_100000210338_100000042856 [0,1,0,0,0,0|2,0,1]=4 2195 B15R1.1208 C=C(COc1ccccc1Cl)OCOC 34a_100000210172_100000042856 [0,1,0,0,0,0|2,0,1]=4 2196 B15R1.1208 C=C(COc1ccccc1F)OCOC 34a_100000210171_100000042856 [0,1,0,0,0,0|2,0,1]=4 2197 B15R1.1208 C=C(COc1ccccc1I)OCOC 34a_100000739446_100000042856 [0,1,0,0,0,0|2,0,1]=4 2198 B15R1.1208 C=C(COc1ccccc1N)OCOC 34a_100000185747_100000042856 [0,1,0,0,0,0|2,0,1]=4 2199 B15R1.1208 C=CC=CC(=O)CCc1ccccc1Br 1458a_100016291481_100012161201 [0,1,0,0,0,0|2,0,1]=4 2200 B15R1.1208 C=CC=CC(=O)CCc1ccccc1C 1458a_100016291481_100011713688 [0,1,0,0,0,0|2,0,1]=4 2201 B15R1.1208 C=CC=CC(=O)CCc1ccccc1Cl 1458a_100016291481_100011713703 [0,1,0,0,0,0|2,0,1]=4 2202 B15R1.1208 C=CC=CC(=O)CCc1ccccc1F 1458a_100016291481_100000720011 [0,1,0,0,0,0|2,0,1]=4 2203 B15R1.1208 C=CC=CC(=O)CCc1ccccc1O 1458a_100016291481_100000722297 [0,1,0,0,0,0|2,0,1]=4 2204 B15R1.1208 C=CCCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000754431 [0,1,0,0,0,0|2,0,1]=4 2205 B15R1.1208 C=CCCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000754431 [0,1,0,0,0,0|2,0,1]=4 2206 B15R1.1208 C=CCCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000754431 [0,1,0,0,0,0|2,0,1]=4 2207 B15R1.1208 C=CCCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000754431 [0,1,0,0,0,0|2,0,1]=4 2208 B15R1.1208 C=CCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000754431 [0,1,0,0,0,0|2,0,1]=4 2209 B15R1.1208 C=CCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000754431 [0,1,0,0,0,0|2,0,0]=3 2210 B15R1.1208 C=CCCC(=O)CCc1ccccc1Br 1458a_100000749702_100012161201 [0,1,0,0,0,0|2,0,0]=3 2211 B15R1.1208 C=CCCC(=O)CCc1ccccc1C 1458a_100000748742_100000754431 [0,1,0,0,0,0|2,0,0]=3 2212 B15R1.1208 C=CCCC(=O)CCc1ccccc1C 1458a_100000749702_100011713688 [0,1,0,0,0,0|2,0,0]=3 2213 B15R1.1208 C=CCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000754431 [0,1,0,0,0,0|2,0,0]=3 2214 B15R1.1208 C=CCCC(=O)CCc1ccccc1Cl 1458a_100000749702_100011713703 [0,1,0,0,0,0|2,0,0]=3 2215 B15R1.1208 C=CCCC(=O)CCc1ccccc1F 1458a_100000189703_100000754431 [0,1,0,0,0,0|2,0,0]=3 2216 B15R1.1208 C=CCCC(=O)CCc1ccccc1F 1458a_100000749702_100000720011 [0,1,0,0,0,0|2,0,0]=3 2217 B15R1.1208 C=CCCC(=O)CCc1ccccc1I 1458a_100000037306_100000754431 [0,1,0,0,0,0|2,0,0]=3 2218 B15R1.1208 C=CCCC(=O)CCc1ccccc1O 1458a_100000181328_100000754431 [0,1,0,0,0,0|2,0,0]=3 2219 B15R1.1208 C=CCCC(=O)CCc1ccccc1O 1458a_100000749702_100000722297 [0,1,0,0,0,0|2,0,0]=3 2220 B15R1.1208 C=CCCC(=O)CCn1ccccc1=O 1458a_100000738505_100000754431 [0,1,0,0,0,0|3,0,0]=4 2221 B15R1.1208 C=CCCC(=O)COc1ccccc1Br 1458a_100000216496_100000754431 [0,1,0,0,0,0|1,0,0]=2 2222 B15R1.1208 C=CCCC(=O)COc1ccccc1C 1458a_100000182418_100000754431 [0,1,0,0,0,0|1,0,0]=2 2223 B15R1.1208 C=CCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000754431 [0,1,0,0,0,0|1,0,0]=2 2224 B15R1.1208 C=CCCC(=O)COc1ccccc1F 1458a_100000182486_100000754431 [0,1,0,0,0,0|1,0,0]=2 2225 B15R1.1208 C=CCCC(=O)COc1ccccc1O 1458a_100000183020_100000754431 [0,1,0,0,0,0|1,0,0]=2 2226 B15R1.1208 C=CCCC(=O)CSc1ccccc1C 1458a_100000183026_100000754431 [0,1,0,0,0,0|1,1,0]=3 2227 B15R1.1208 C=CCCC(=O)CSc1ccccc1F 1458a_100000179528_100000754431 [0,1,0,0,0,0|1,1,0]=3 2228 B15R1.1208 C=CCCC(=O)CSc1ccccc1O 1458a_100000695322_100000754431 [0,1,0,0,0,0|1,1,0]=3 2229 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br 11a_100000689332_100000749702 [0,1,0,0,0,0|3,0,0]=4 2230 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000749702 [0,1,0,0,0,0|3,0,0]=4 2231 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000749702 [0,1,0,0,0,0|3,0,0]=4 2232 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br 527a_100000689332_100000749702 [0,1,0,0,0,0|3,0,0]=4 2233 B15R1.1208 C=CCCC(=O)NCc1ccccc1C 11a_100000174972_100000749702 [0,1,0,0,0,0|3,0,0]=4 2234 B15R1.1208 C=CCCC(=O)NCc1ccccc1C 1626a_100000174972_100000749702 [0,1,0,0,0,0|3,0,0]=4 2235 B15R1.1208 C=CCCC(=O)NCc1ccccc1C 240690a_100000174972_100000749702 [0,1,0,0,0,0|3,0,0]=4 2236 B15R1.1208 C=CCCC(=O)NCc1ccccc1C 527a_100000174972_100000749702 [0,1,0,0,0,0|3,0,0]=4 2237 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000749702 [0,1,0,0,0,0|3,0,0]=4 2238 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000749702 [0,1,0,0,0,0|3,0,0]=4 2239 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000749702 [0,1,0,0,0,0|3,0,0]=4 2240 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000749702 [0,1,0,0,0,0|3,0,0]=4 2241 B15R1.1208 C=CCCC(=O)NCc1ccccc1F 11a_100000174869_100000749702 [0,1,0,0,0,0|3,0,0]=4 2242 B15R1.1208 C=CCCC(=O)NCc1ccccc1F 1626a_100000174869_100000749702 [0,1,0,0,0,0|3,0,0]=4 2243 B15R1.1208 C=CCCC(=O)NCc1ccccc1F 240690a_100000174869_100000749702 [0,1,0,0,0,0|3,0,0]=4 2244 B15R1.1208 C=CCCC(=O)NCc1ccccc1F 527a_100000174869_100000749702 [0,1,0,0,0,0|3,0,0]=4 2245 B15R1.1208 C=CCCC(=O)NCc1ccccc1I 11a_100015347259_100000749702 [0,1,0,0,0,0|3,0,0]=4 2246 B15R1.1208 C=CCCC(=O)NCc1ccccc1I 1626a_100015347259_100000749702 [0,1,0,0,0,0|3,0,0]=4 2247 B15R1.1208 C=CCCC(=O)NCc1ccccc1I 240690a_100015347259_100000749702 [0,1,0,0,0,0|3,0,0]=4 2248 B15R1.1208 C=CCCC(=O)NCc1ccccc1I 527a_100015347259_100000749702 [0,1,0,0,0,0|3,0,0]=4 2249 B15R1.1208 C=CCCC(=O)NCc1ccccc1O 240690a_100000185550_100000749702 [0,1,0,0,0,0|3,0,0]=4 2250 B15R1.1208 C=CCCC(=O)NCc1ccccc1O 527a_100000185550_100000749702 [0,1,0,0,0,0|3,0,0]=4 2251 B15R1.1208 C=CCCC(=O)NNc1ccccc1Br 22a_100000241748_100000749702 [0,1,0,0,0,0|3,0,0]=4 2252 B15R1.1208 C=CCCC(=O)NNc1ccccc1C 22a_100000184220_100000749702 [0,1,0,0,0,0|3,0,0]=4 2253 B15R1.1208 C=CCCC(=O)NNc1ccccc1Cl 22a_100000683529_100000749702 [0,1,0,0,0,0|3,0,0]=4 2254 B15R1.1208 C=CCCC(=O)NNc1ccccc1F 22a_100000239246_100000749702 [0,1,0,0,0,0|3,0,0]=4 2255 B15R1.1208 C=CCCC(=O)NNc1ccccc1I 22a_100011218156_100000749702 [0,1,0,0,0,0|3,0,0]=4 2256 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Br 1626a_100020586998_100000719032 [0,1,0,0,0,0|2,0,1]=4 2257 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Br 240690a_100020586998_100000719032 [0,1,0,0,0,0|2,0,1]=4 2258 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1C 1626a_100020586998_100016266485 [0,1,0,0,0,0|2,0,1]=4 2259 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Cl 1626a_100020586998_100000720304 [0,1,0,0,0,0|2,0,1]=4 2260 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Cl 240690a_100020586998_100000720304 [0,1,0,0,0,0|2,0,1]=4 2261 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1F 1626a_100020586998_100016256065 [0,1,0,0,0,0|2,0,1]=4 2262 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1F 240690a_100020586998_100016256065 [0,1,0,0,0,0|2,0,1]=4 2263 B15R1.1208 C=CCNC(=O)CCc1ccccc1Br 1626a_100020586998_100000740810 [0,1,0,0,0,0|2,0,0]=3 2264 B15R1.1208 C=CCNC(=O)CCc1ccccc1Br 240690a_100020586998_100000740810 [0,1,0,0,0,0|2,0,0]=3 2265 B15R1.1208 C=CCNC(=O)CCc1ccccc1Br 527a_100020586998_100000740810 [0,1,0,0,0,0|2,0,0]=3 2266 B15R1.1208 C=CCNC(=O)CCc1ccccc1C 1626a_100020586998_100000748742 [0,1,0,0,0,0|2,0,0]=3 2267 B15R1.1208 C=CCNC(=O)CCc1ccccc1C 240690a_100020586998_100000748742 [0,1,0,0,0,0|2,0,0]=3 2268 B15R1.1208 C=CCNC(=O)CCc1ccccc1C 527a_100020586998_100000748742 [0,1,0,0,0,0|2,0,0]=3 2269 B15R1.1208 C=CCNC(=O)CCc1ccccc1Cl 1626a_100020586998_100000184300 [0,1,0,0,0,0|2,0,0]=3 2270 B15R1.1208 C=CCNC(=O)CCc1ccccc1Cl 240690a_100020586998_100000184300 [0,1,0,0,0,0|2,0,0]=3 2271 B15R1.1208 C=CCNC(=O)CCc1ccccc1Cl 527a_100020586998_100000184300 [0,1,0,0,0,0|2,0,0]=3 2272 B15R1.1208 C=CCNC(=O)CCc1ccccc1F 1626a_100020586998_100000189703 [0,1,0,0,0,0|2,0,0]=3 2273 B15R1.1208 C=CCNC(=O)CCc1ccccc1F 240690a_100020586998_100000189703 [0,1,0,0,0,0|2,0,0]=3 2274 B15R1.1208 C=CCNC(=O)CCc1ccccc1F 527a_100020586998_100000189703 [0,1,0,0,0,0|2,0,0]=3 2275 B15R1.1208 C=CCNC(=O)CCc1ccccc1I 1626a_100020586998_100000037306 [0,1,0,0,0,0|2,0,0]=3 2276 B15R1.1208 C=CCNC(=O)CCc1ccccc1I 240690a_100020586998_100000037306 [0,1,0,0,0,0|2,0,0]=3 2277 B15R1.1208 C=CCNC(=O)CCc1ccccc1I 527a_100020586998_100000037306 [0,1,0,0,0,0|2,0,0]=3 2278 B15R1.1208 C=CCNC(=O)CCc1ccccc1O 240690a_100020586998_100000181328 [0,1,0,0,0,0|2,0,0]=3 2279 B15R1.1208 C=CCNC(=O)CCc1ccccc1O 527a_100020586998_100000181328 [0,1,0,0,0,0|2,0,0]=3 2280 B15R1.1208 C=CCNC(=O)CCn1ccccc1=O 1626a_100020586998_100000738505 [0,1,0,0,0,0|3,0,0]=4 2281 B15R1.1208 C=CCNC(=O)CCn1ccccc1=O 240690a_100020586998_100000738505 [0,1,0,0,0,0|3,0,0]=4 2282 B15R1.1208 C=CCNC(=O)CCn1ccccc1=O 527a_100020586998_100000738505 [0,1,0,0,0,0|3,0,0]=4 2283 B15R1.1208 C=CCNC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000183597 [0,1,0,0,0,0|2,0,0]=3 2284 B15R1.1208 C=CCNC(=O)COc1ccccc1Br 1626a_100020586998_100000216496 [0,1,0,0,0,0|1,0,0]=2 2285 B15R1.1208 C=CCNC(=O)COc1ccccc1Br 240690a_100020586998_100000216496 [0,1,0,0,0,0|1,0,0]=2 2286 B15R1.1208 C=CCNC(=O)COc1ccccc1Br 527a_100020586998_100000216496 [0,1,0,0,0,0|1,0,0]=2 2287 B15R1.1208 C=CCNC(=O)COc1ccccc1Br 7a_100000181306_100000183597 [0,1,0,0,0,0|1,0,0]=2 2288 B15R1.1208 C=CCNC(=O)COc1ccccc1C 1626a_100020586998_100000182418 [0,1,0,0,0,0|1,0,0]=2 2289 B15R1.1208 C=CCNC(=O)COc1ccccc1C 240690a_100020586998_100000182418 [0,1,0,0,0,0|1,0,0]=2 2290 B15R1.1208 C=CCNC(=O)COc1ccccc1C 527a_100020586998_100000182418 [0,1,0,0,0,0|1,0,0]=2 2291 B15R1.1208 C=CCNC(=O)COc1ccccc1C 7a_100000210338_100000183597 [0,1,0,0,0,0|1,0,0]=2 2292 B15R1.1208 C=CCNC(=O)COc1ccccc1Cl 1626a_100020586998_100000185159 [0,1,0,0,0,0|1,0,0]=2 2293 B15R1.1208 C=CCNC(=O)COc1ccccc1Cl 240690a_100020586998_100000185159 [0,1,0,0,0,0|1,0,0]=2 2294 B15R1.1208 C=CCNC(=O)COc1ccccc1Cl 527a_100020586998_100000185159 [0,1,0,0,0,0|1,0,0]=2 2295 B15R1.1208 C=CCNC(=O)COc1ccccc1Cl 7a_100000210172_100000183597 [0,1,0,0,0,0|1,0,0]=2 2296 B15R1.1208 C=CCNC(=O)COc1ccccc1F 1626a_100020586998_100000182486 [0,1,0,0,0,0|1,0,0]=2 2297 B15R1.1208 C=CCNC(=O)COc1ccccc1F 240690a_100020586998_100000182486 [0,1,0,0,0,0|1,0,0]=2 2298 B15R1.1208 C=CCNC(=O)COc1ccccc1F 527a_100020586998_100000182486 [0,1,0,0,0,0|1,0,0]=2 2299 B15R1.1208 C=CCNC(=O)COc1ccccc1F 7a_100000210171_100000183597 [0,1,0,0,0,0|1,0,0]=2 2300 B15R1.1208 C=CCNC(=O)COc1ccccc1I 7a_100000739446_100000183597 [0,1,0,0,0,0|1,0,0]=2 2301 B15R1.1208 C=CCNC(=O)COc1ccccc1N 7a_100000185747_100000183597 [0,1,0,0,0,0|1,0,0]=2 2302 B15R1.1208 C=CCNC(=O)COc1ccccc1O 240690a_100020586998_100000183020 [0,1,0,0,0,0|1,0,0]=2 2303 B15R1.1208 C=CCNC(=O)COc1ccccc1O 527a_100020586998_100000183020 [0,1,0,0,0,0|1,0,0]=2 2304 B15R1.1208 C=CCNC(=O)COc1cccnc1Br 7a_100000744436_100000183597 [0,1,0,0,0,0|2,0,0]=3 2305 B15R1.1208 C=CCNC(=O)COc1cccnc1C 7a_100000745507_100000183597 [0,1,0,0,0,0|2,0,0]=3 2306 B15R1.1208 C=CCNC(=O)COc1cccnc1Cl 7a_100000757616_100000183597 [0,1,0,0,0,0|2,0,0]=3 2307 B15R1.1208 C=CCNC(=O)COc1cccnc1F 7a_100000061740_100000183597 [0,1,0,0,0,0|2,0,0]=3 2308 B15R1.1208 C=CCNC(=O)COc1cccnc1I 7a_100000034122_100000183597 [0,1,0,0,0,0|2,0,0]=3 2309 B15R1.1208 C=CCNC(=O)COc1cccnc1N 7a_100000211975_100000183597 [0,1,0,0,0,0|2,0,0]=3 2310 B15R1.1208 C=CCNC(=O)COc1cccoc1=O 7a_100000077404_100000183597 [0,1,0,0,0,0|2,0,0]=3 2311 B15R1.1208 C=CCNC(=O)COc1cnccc1C 7a_100011997053_100000183597 [0,1,0,0,0,0|2,0,0]=3 2312 B15R1.1208 C=CCNC(=O)COc1cncnc1N 7a_100000112926_100000183597 [0,1,0,0,0,0|3,0,0]=4 2313 B15R1.1208 C=CCNC(=O)CSc1c[nH]ccc1=O 62a_100000183597_100009998708 [0,1,0,0,0,0|2,1,0]=4 2314 B15R1.1208 C=CCNC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000183597 [0,1,0,0,0,0|2,1,0]=4 2315 B15R1.1208 C=CCNC(=O)CSc1c[nH]ccc1=S 62a_100000183597_200012280681 [0,1,0,0,0,0|2,1,0]=4 2316 B15R1.1208 C=CCNC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000183597 [0,1,0,0,0,0|2,1,0]=4 2317 B15R1.1208 C=CCNC(=O)CSc1cccc[n+]1C 62a_100000183597_100000212160 [0,1,0,0,0,0|2,1,0]=4 2318 B15R1.1208 C=CCNC(=O)CSc1cccc[n+]1[O-] 62a_100000183597_200000042595 [0,1,0,0,0,0|2,1,0]=4 2319 B15R1.1208 C=CCNC(=O)CSc1ccccc1Br 62a_100000183597_100000695589 [0,1,0,0,0,0|1,1,0]=3 2320 B15R1.1208 C=CCNC(=O)CSc1ccccc1Br 62a_100000695589_100000183597 [0,1,0,0,0,0|1,1,0]=3 2321 B15R1.1208 C=CCNC(=O)CSc1ccccc1C 1626a_100020586998_100000183026 [0,1,0,0,0,0|1,1,0]=3 2322 B15R1.1208 C=CCNC(=O)CSc1ccccc1C 240690a_100020586998_100000183026 [0,1,0,0,0,0|1,1,0]=3 2323 B15R1.1208 C=CCNC(=O)CSc1ccccc1C 527a_100020586998_100000183026 [0,1,0,0,0,0|1,1,0]=3 2324 B15R1.1208 C=CCNC(=O)CSc1ccccc1C 62a_100000183597_100000210755 [0,1,0,0,0,0|1,1,0]=3 2325 B15R1.1208 C=CCNC(=O)CSc1ccccc1C 62a_100000210755_100000183597 [0,1,0,0,0,0|1,1,0]=3 2326 B15R1.1208 C=CCNC(=O)CSc1ccccc1Cl 62a_100000183597_100000764095 [0,1,0,0,0,0|1,1,0]=3 2327 B15R1.1208 C=CCNC(=O)CSc1ccccc1Cl 62a_100000764095_100000183597 [0,1,0,0,0,0|1,1,0]=3 2328 B15R1.1208 C=CCNC(=O)CSc1ccccc1F 1626a_100020586998_100000179528 [0,1,0,0,0,0|1,1,0]=3 2329 B15R1.1208 C=CCNC(=O)CSc1ccccc1F 240690a_100020586998_100000179528 [0,1,0,0,0,0|1,1,0]=3 2330 B15R1.1208 C=CCNC(=O)CSc1ccccc1F 62a_100000183597_100011215700 [0,1,0,0,0,0|1,1,0]=3 2331 B15R1.1208 C=CCNC(=O)CSc1ccccc1F 62a_100011215700_100000183597 [0,1,0,0,0,0|1,1,0]=3 2332 B15R1.1208 C=CCNC(=O)CSc1ccccc1N 62a_100000183597_100000210017 [0,1,0,0,0,0|1,1,0]=3 2333 B15R1.1208 C=CCNC(=O)CSc1ccccc1N 62a_100000210017_100000183597 [0,1,0,0,0,0|1,1,0]=3 2334 B15R1.1208 C=CCNC(=O)CSc1ccccc1O 240690a_100020586998_100000695322 [0,1,0,0,0,0|1,1,0]=3 2335 B15R1.1208 C=CCNC(=O)CSc1ccccc1O 527a_100020586998_100000695322 [0,1,0,0,0,0|1,1,0]=3 2336 B15R1.1208 C=CCNC(=O)CSc1ccccc1O 62a_100000183597_100000739446 [0,1,0,0,0,0|1,1,0]=3 2337 B15R1.1208 C=CCNC(=O)CSc1ccccc1O 62a_100000739446_100000183597 [0,1,0,0,0,0|1,1,0]=3 2338 B15R1.1208 C=CCNC(=O)CSc1cccnc1Br 62a_100000183597_100010202626 [0,1,0,0,0,0|2,1,0]=4 2339 B15R1.1208 C=CCNC(=O)CSc1cccnc1Br 62a_100010202626_100000183597 [0,1,0,0,0,0|2,1,0]=4 2340 B15R1.1208 C=CCNC(=O)CSc1cccnc1C 62a_100000183597_100000751574 [0,1,0,0,0,0|2,1,0]=4 2341 B15R1.1208 C=CCNC(=O)CSc1cccnc1C 62a_100000751574_100000183597 [0,1,0,0,0,0|2,1,0]=4 2342 B15R1.1208 C=CCNC(=O)CSc1cccnc1Cl 62a_100000036424_100000183597 [0,1,0,0,0,0|2,1,0]=4 2343 B15R1.1208 C=CCNC(=O)CSc1cccnc1Cl 62a_100000183597_100000036424 [0,1,0,0,0,0|2,1,0]=4 2344 B15R1.1208 C=CCNC(=O)CSc1cccnc1F 62a_100000183597_100009816115 [0,1,0,0,0,0|2,1,0]=4 2345 B15R1.1208 C=CCNC(=O)CSc1cccnc1F 62a_100009816115_100000183597 [0,1,0,0,0,0|2,1,0]=4 2346 B15R1.1208 C=CCNC(=O)CSc1cccnc1N 62a_100000045569_100000183597 [0,1,0,0,0,0|2,1,0]=4 2347 B15R1.1208 C=CCNC(=O)CSc1cccnc1N 62a_100000183597_100000045569 [0,1,0,0,0,0|2,1,0]=4 2348 B15R1.1208 C=CCNC(=O)CSc1cccnc1O 62a_100000183597_100000760158 [0,1,0,0,0,0|2,1,0]=4 2349 B15R1.1208 C=CCNC(=O)CSc1cccnc1O 62a_100000760158_100000183597 [0,1,0,0,0,0|2,1,0]=4 2350 B15R1.1208 C=CCNC(=O)CSc1ccncc1Br 62a_100000183597_100000726257 [0,1,0,0,0,0|2,1,0]=4 2351 B15R1.1208 C=CCNC(=O)CSc1ccncc1Br 62a_100000726257_100000183597 [0,1,0,0,0,0|2,1,0]=4 2352 B15R1.1208 C=CCNC(=O)CSc1ccncc1C 62a_100000183597_100000765111 [0,1,0,0,0,0|2,1,0]=4 2353 B15R1.1208 C=CCNC(=O)CSc1ccncc1C 62a_100000765111_100000183597 [0,1,0,0,0,0|2,1,0]=4 2354 B15R1.1208 C=CCNC(=O)CSc1ccncc1Cl 62a_100000183597_100000708259 [0,1,0,0,0,0|2,1,0]=4 2355 B15R1.1208 C=CCNC(=O)CSc1ccncc1Cl 62a_100000708259_100000183597 [0,1,0,0,0,0|2,1,0]=4 2356 B15R1.1208 C=CCNC(=O)CSc1ccncc1F 62a_100000047030_100000183597 [0,1,0,0,0,0|2,1,0]=4 2357 B15R1.1208 C=CCNC(=O)CSc1ccncc1F 62a_100000183597_100000047030 [0,1,0,0,0,0|2,1,0]=4 2358 B15R1.1208 C=CCNC(=O)CSc1ccncc1N 62a_100000183597_100000756074 [0,1,0,0,0,0|2,1,0]=4 2359 B15R1.1208 C=CCNC(=O)CSc1ccncc1N 62a_100000756074_100000183597 [0,1,0,0,0,0|2,1,0]=4 2360 B15R1.1208 C=CCNC(=O)CSc1ccncc1O 62a_100000183597_100009817591 [0,1,0,0,0,0|2,1,0]=4 2361 B15R1.1208 C=CCNC(=O)CSc1ccncc1O 62a_100009817591_100000183597 [0,1,0,0,0,0|2,1,0]=4 2362 B15R1.1208 C=CCNC(=O)CSc1cnccc1Br 62a_100000183597_100010138639 [0,1,0,0,0,0|2,1,0]=4 2363 B15R1.1208 C=CCNC(=O)CSc1cnccc1Br 62a_100010138639_100000183597 [0,1,0,0,0,0|2,1,0]=4 2364 B15R1.1208 C=CCNC(=O)CSc1cnccc1C 62a_100000183597_100000761580 [0,1,0,0,0,0|2,1,0]=4 2365 B15R1.1208 C=CCNC(=O)CSc1cnccc1C 62a_100000761580_100000183597 [0,1,0,0,0,0|2,1,0]=4 2366 B15R1.1208 C=CCNC(=O)CSc1cnccc1Cl 62a_100000183597_100009995489 [0,1,0,0,0,0|2,1,0]=4 2367 B15R1.1208 C=CCNC(=O)CSc1cnccc1Cl 62a_100009995489_100000183597 [0,1,0,0,0,0|2,1,0]=4 2368 B15R1.1208 C=CCNC(=O)CSc1cnccc1F 62a_100000183597_100009820683 [0,1,0,0,0,0|2,1,0]=4 2369 B15R1.1208 C=CCNC(=O)CSc1cnccc1F 62a_100009820683_100000183597 [0,1,0,0,0,0|2,1,0]=4 2370 B15R1.1208 C=CCNC(=O)CSc1cnccc1N 62a_100000047001_100000183597 [0,1,0,0,0,0|2,1,0]=4 2371 B15R1.1208 C=CCNC(=O)CSc1cnccc1N 62a_100000183597_100000047001 [0,1,0,0,0,0|2,1,0]=4 2372 B15R1.1208 C=CCNC(=O)CSc1ncccc1Br 62a_100000183597_100000696092 [0,1,0,0,0,0|2,1,0]=4 2373 B15R1.1208 C=CCNC(=O)CSc1ncccc1Br 62a_100000696092_100000183597 [0,1,0,0,0,0|2,1,0]=4 2374 B15R1.1208 C=CCNC(=O)CSc1ncccc1C 62a_100000183597_100000751373 [0,1,0,0,0,0|2,1,0]=4 2375 B15R1.1208 C=CCNC(=O)CSc1ncccc1C 62a_100000751373_100000183597 [0,1,0,0,0,0|2,1,0]=4 2376 B15R1.1208 C=CCNC(=O)CSc1ncccc1Cl 62a_100000183597_100011356963 [0,1,0,0,0,0|2,1,0]=4 2377 B15R1.1208 C=CCNC(=O)CSc1ncccc1Cl 62a_100011356963_100000183597 [0,1,0,0,0,0|2,1,0]=4 2378 B15R1.1208 C=CCNC(=O)CSc1ncccc1F 62a_100000183597_100000685392 [0,1,0,0,0,0|2,1,0]=4 2379 B15R1.1208 C=CCNC(=O)CSc1ncccc1F 62a_100000685392_100000183597 [0,1,0,0,0,0|2,1,0]=4 2380 B15R1.1208 C=CCNC(=O)CSc1ncccc1N 62a_100000183597_100000688686 [0,1,0,0,0,0|2,1,0]=4 2381 B15R1.1208 C=CCNC(=O)CSc1ncccc1N 62a_100000688686_100000183597 [0,1,0,0,0,0|2,1,0]=4 2382 B15R1.1208 C=CCNC(=O)CSc1ncccc1O 62a_100000034122_100000183597 [0,1,0,0,0,0|2,1,0]=4 2383 B15R1.1208 C=CCNC(=O)CSc1ncccc1O 62a_100000183597_100000034122 [0,1,0,0,0,0|2,1,0]=4 2384 B15R1.1208 C=CCNC(=O)NCc1ccccc1Br 2708a_100000689332_100020586998 [0,1,0,0,0,0|3,0,0]=4 2385 B15R1.1208 C=CCNC(=O)NCc1ccccc1Br 273464a_100000689332_100020586998 [0,1,0,0,0,0|3,0,0]=4 2386 B15R1.1208 C=CCNC(=O)NCc1ccccc1Br 273464a_100020586998_100000689332 [0,1,0,0,0,0|3,0,0]=4 2387 B15R1.1208 C=CCNC(=O)NCc1ccccc1Br 512a_100000689332_100020586998 [0,1,0,0,0,0|3,0,0]=4 2388 B15R1.1208 C=CCNC(=O)NCc1ccccc1Br 512a_100020586998_100000689332 [0,1,0,0,0,0|3,0,0]=4 2389 B15R1.1208 C=CCNC(=O)NCc1ccccc1C 2708a_100000174972_100020586998 [0,1,0,0,0,0|3,0,0]=4 2390 B15R1.1208 C=CCNC(=O)NCc1ccccc1C 273464a_100000174972_100020586998 [0,1,0,0,0,0|3,0,0]=4 2391 B15R1.1208 C=CCNC(=O)NCc1ccccc1C 273464a_100020586998_100000174972 [0,1,0,0,0,0|3,0,0]=4 2392 B15R1.1208 C=CCNC(=O)NCc1ccccc1C 512a_100000174972_100020586998 [0,1,0,0,0,0|3,0,0]=4 2393 B15R1.1208 C=CCNC(=O)NCc1ccccc1C 512a_100020586998_100000174972 [0,1,0,0,0,0|3,0,0]=4 2394 B15R1.1208 C=CCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100020586998 [0,1,0,0,0,0|3,0,0]=4 2395 B15R1.1208 C=CCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100020586998 [0,1,0,0,0,0|3,0,0]=4 2396 B15R1.1208 C=CCNC(=O)NCc1ccccc1Cl 273464a_100020586998_100000174879 [0,1,0,0,0,0|3,0,0]=4 2397 B15R1.1208 C=CCNC(=O)NCc1ccccc1Cl 512a_100020586998_100000174879 [0,1,0,0,0,0|3,0,0]=4 2398 B15R1.1208 C=CCNC(=O)NCc1ccccc1F 2708a_100000174869_100020586998 [0,1,0,0,0,0|3,0,0]=4 2399 B15R1.1208 C=CCNC(=O)NCc1ccccc1F 273464a_100000174869_100020586998 [0,1,0,0,0,0|3,0,0]=4 2400 B15R1.1208 C=CCNC(=O)NCc1ccccc1F 273464a_100020586998_100000174869 [0,1,0,0,0,0|3,0,0]=4 2401 B15R1.1208 C=CCNC(=O)NCc1ccccc1F 512a_100000174869_100020586998 [0,1,0,0,0,0|3,0,0]=4 2402 B15R1.1208 C=CCNC(=O)NCc1ccccc1F 512a_100020586998_100000174869 [0,1,0,0,0,0|3,0,0]=4 2403 B15R1.1208 C=CCNC(=O)NCc1ccccc1I 2708a_100015347259_100020586998 [0,1,0,0,0,0|3,0,0]=4 2404 B15R1.1208 C=CCNC(=O)NCc1ccccc1I 273464a_100015347259_100020586998 [0,1,0,0,0,0|3,0,0]=4 2405 B15R1.1208 C=CCNC(=O)NCc1ccccc1I 273464a_100020586998_100015347259 [0,1,0,0,0,0|3,0,0]=4 2406 B15R1.1208 C=CCNC(=O)NCc1ccccc1I 512a_100015347259_100020586998 [0,1,0,0,0,0|3,0,0]=4 2407 B15R1.1208 C=CCNC(=O)NCc1ccccc1I 512a_100020586998_100015347259 [0,1,0,0,0,0|3,0,0]=4 2408 B15R1.1208 C=CCNC(=O)NCc1ccccc1O 2708a_100000185550_100020586998 [0,1,0,0,0,0|3,0,0]=4 2409 B15R1.1208 C=CCNC(=O)NCc1ccccc1O 273464a_100000185550_100020586998 [0,1,0,0,0,0|3,0,0]=4 2410 B15R1.1208 C=CCNC(=O)NCc1ccccc1O 273464a_100020586998_100000185550 [0,1,0,0,0,0|3,0,0]=4 2411 B15R1.1208 C=CCNC(=O)NCc1ccccc1O 512a_100000185550_100020586998 [0,1,0,0,0,0|3,0,0]=4 2412 B15R1.1208 C=CCNC(=O)NNc1ccccc1Br 273464a_100020586998_100000241748 [0,1,0,0,0,0|3,0,0]=4 2413 B15R1.1208 C=CCNC(=O)NNc1ccccc1Br 512a_100020586998_100000241748 [0,1,0,0,0,0|3,0,0]=4 2414 B15R1.1208 C=CCNC(=O)NNc1ccccc1C 273464a_100020586998_100000184220 [0,1,0,0,0,0|3,0,0]=4 2415 B15R1.1208 C=CCNC(=O)NNc1ccccc1C 512a_100020586998_100000184220 [0,1,0,0,0,0|3,0,0]=4 2416 B15R1.1208 C=CCNC(=O)NNc1ccccc1Cl 273464a_100020586998_100000683529 [0,1,0,0,0,0|3,0,0]=4 2417 B15R1.1208 C=CCNC(=O)NNc1ccccc1Cl 512a_100020586998_100000683529 [0,1,0,0,0,0|3,0,0]=4 2418 B15R1.1208 C=CCNC(=O)NNc1ccccc1F 273464a_100020586998_100000239246 [0,1,0,0,0,0|3,0,0]=4 2419 B15R1.1208 C=CCNC(=O)NNc1ccccc1F 512a_100020586998_100000239246 [0,1,0,0,0,0|3,0,0]=4 2420 B15R1.1208 C=CCNC(=O)NNc1ccccc1I 273464a_100020586998_100011218156 [0,1,0,0,0,0|3,0,0]=4 2421 B15R1.1208 C=CCNC(=O)NNc1ccccc1I 512a_100020586998_100011218156 [0,1,0,0,0,0|3,0,0]=4 2422 B15R1.1208 C=CCNC(C)COc1ccccc1C 2230a_100000744241_100000210623 [0,1,0,0,0,0|2,0,1]=4 2423 B15R1.1208 C=CCNC(C)COc1ccccc1C 34a_100000744241_100015514636 [0,1,0,0,0,0|2,0,1]=4 2424 B15R1.1208 C=CCOC(=O)CNc1ccccc1Br 34a_100000210017_100000033060 [0,1,0,0,0,0|1,0,0]=2 2425 B15R1.1208 C=CCOC(=O)CNc1ccccc1C 34a_100015192222_100000033060 [0,1,0,0,0,0|1,0,0]=2 2426 B15R1.1208 C=CCOC(=O)CNc1ccccc1Cl 34a_100000185783_100000033060 [0,1,0,0,0,0|1,0,0]=2 2427 B15R1.1208 C=CCOC(=O)CNc1ccccc1F 34a_100000210422_100000033060 [0,1,0,0,0,0|1,0,0]=2 2428 B15R1.1208 C=CCOC(=O)CNc1ccccc1I 34a_100000210053_100000033060 [0,1,0,0,0,0|1,0,0]=2 2429 B15R1.1208 C=CCOC(=O)CNc1ccccc1O 34a_100000185747_100000033060 [0,1,0,0,0,0|1,0,0]=2 2430 B15R1.1208 C=CCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000033060 [0,1,0,0,0,0|1,0,0]=2 2431 B15R1.1208 C=CCOC(=O)COc1ccccc1Br 34a_100000181306_100000033060 [0,1,0,0,0,0|0,0,0]=1 2432 B15R1.1208 C=CCOC(=O)COc1ccccc1Br 7a_100000181306_100000033060 [0,1,0,0,0,0|0,0,0]=1 2433 B15R1.1208 C=CCOC(=O)COc1ccccc1C 34a_100000210338_100000033060 [0,1,0,0,0,0|0,0,0]=1 2434 B15R1.1208 C=CCOC(=O)COc1ccccc1C 7a_100000210338_100000033060 [0,1,0,0,0,0|0,0,0]=1 2435 B15R1.1208 C=CCOC(=O)COc1ccccc1Cl 34a_100000210172_100000033060 [0,1,0,0,0,0|0,0,0]=1 2436 B15R1.1208 C=CCOC(=O)COc1ccccc1Cl 7a_100000210172_100000033060 [0,1,0,0,0,0|0,0,0]=1 2437 B15R1.1208 C=CCOC(=O)COc1ccccc1F 34a_100000210171_100000033060 [0,1,0,0,0,0|0,0,0]=1 2438 B15R1.1208 C=CCOC(=O)COc1ccccc1F 7a_100000210171_100000033060 [0,1,0,0,0,0|0,0,0]=1 2439 B15R1.1208 C=CCOC(=O)COc1ccccc1I 34a_100000739446_100000033060 [0,1,0,0,0,0|0,0,0]=1 2440 B15R1.1208 C=CCOC(=O)COc1ccccc1I 7a_100000739446_100000033060 [0,1,0,0,0,0|0,0,0]=1 2441 B15R1.1208 C=CCOC(=O)COc1ccccc1N 34a_100000185747_100000033060 [0,1,0,0,0,0|0,0,0]=1 2442 B15R1.1208 C=CCOC(=O)COc1ccccc1N 7a_100000185747_100000033060 [0,1,0,0,0,0|0,0,0]=1 2443 B15R1.1208 C=CCOC(=O)COc1cccnc1Br 34a_100000744436_100000033060 [0,1,0,0,0,0|1,0,0]=2 2444 B15R1.1208 C=CCOC(=O)COc1cccnc1Br 7a_100000744436_100000033060 [0,1,0,0,0,0|1,0,0]=2 2445 B15R1.1208 C=CCOC(=O)COc1cccnc1C 34a_100000745507_100000033060 [0,1,0,0,0,0|1,0,0]=2 2446 B15R1.1208 C=CCOC(=O)COc1cccnc1C 7a_100000745507_100000033060 [0,1,0,0,0,0|1,0,0]=2 2447 B15R1.1208 C=CCOC(=O)COc1cccnc1Cl 34a_100000757616_100000033060 [0,1,0,0,0,0|1,0,0]=2 2448 B15R1.1208 C=CCOC(=O)COc1cccnc1Cl 7a_100000757616_100000033060 [0,1,0,0,0,0|1,0,0]=2 2449 B15R1.1208 C=CCOC(=O)COc1cccnc1F 34a_100000061740_100000033060 [0,1,0,0,0,0|1,0,0]=2 2450 B15R1.1208 C=CCOC(=O)COc1cccnc1F 7a_100000061740_100000033060 [0,1,0,0,0,0|1,0,0]=2 2451 B15R1.1208 C=CCOC(=O)COc1cccnc1I 34a_100000034122_100000033060 [0,1,0,0,0,0|1,0,0]=2 2452 B15R1.1208 C=CCOC(=O)COc1cccnc1I 7a_100000034122_100000033060 [0,1,0,0,0,0|1,0,0]=2 2453 B15R1.1208 C=CCOC(=O)COc1cccnc1N 34a_100000211975_100000033060 [0,1,0,0,0,0|1,0,0]=2 2454 B15R1.1208 C=CCOC(=O)COc1cccnc1N 7a_100000211975_100000033060 [0,1,0,0,0,0|1,0,0]=2 2455 B15R1.1208 C=CCOC(=O)COc1cccoc1=O 34a_100000077404_100000033060 [0,1,0,0,0,0|1,0,0]=2 2456 B15R1.1208 C=CCOC(=O)COc1cccoc1=O 7a_100000077404_100000033060 [0,1,0,0,0,0|1,0,0]=2 2457 B15R1.1208 C=CCOC(=O)COc1ccncc1Br 34a_100011996408_100000033060 [0,1,0,0,0,0|1,0,0]=2 2458 B15R1.1208 C=CCOC(=O)COc1ccncc1C 34a_100000694293_100000033060 [0,1,0,0,0,0|1,0,0]=2 2459 B15R1.1208 C=CCOC(=O)COc1ccncc1Cl 34a_100011997054_100000033060 [0,1,0,0,0,0|1,0,0]=2 2460 B15R1.1208 C=CCOC(=O)COc1ccncc1F 34a_200000081243_100000033060 [0,1,0,0,0,0|1,0,0]=2 2461 B15R1.1208 C=CCOC(=O)COc1cnccc1C 34a_100011997053_100000033060 [0,1,0,0,0,0|1,0,0]=2 2462 B15R1.1208 C=CCOC(=O)COc1cnccc1C 7a_100011997053_100000033060 [0,1,0,0,0,0|1,0,0]=2 2463 B15R1.1208 C=CCOC(=O)COc1cnccc1Cl 34a_100011996695_100000033060 [0,1,0,0,0,0|1,0,0]=2 2464 B15R1.1208 C=CCOC(=O)COc1cnccc1I 34a_100000050107_100000033060 [0,1,0,0,0,0|1,0,0]=2 2465 B15R1.1208 C=CCOC(=O)COc1cnccc1N 34a_100000753702_100000033060 [0,1,0,0,0,0|1,0,0]=2 2466 B15R1.1208 C=CCOC(=O)COc1cncnc1N 7a_100000112926_100000033060 [0,1,0,0,0,0|2,0,0]=3 2467 B15R1.1208 C=CCOC(=O)COc1coccc1=O 34a_100000060831_100000033060 [0,1,0,0,0,0|1,0,0]=2 2468 B15R1.1208 C=CCOC(=O)COc1ncccc1Cl 34a_100011290957_100000033060 [0,1,0,0,0,0|1,0,0]=2 2469 B15R1.1208 C=CCOC(=O)COc1ncccc1F 34a_100011219419_100000033060 [0,1,0,0,0,0|1,0,0]=2 2470 B15R1.1208 C=CCOC(=O)COc1ncccc1N 34a_100000746358_100000033060 [0,1,0,0,0,0|1,0,0]=2 2471 B15R1.1208 C=CCOC(=O)COc1nccnc1C 34a_100000766352_100000033060 [0,1,0,0,0,0|2,0,0]=3 2472 B15R1.1208 C=CCOC(=O)CSc1c[nH]ccc1=O 62a_100000033060_100009998708 [0,1,0,0,0,0|1,1,0]=3 2473 B15R1.1208 C=CCOC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000033060 [0,1,0,0,0,0|1,1,0]=3 2474 B15R1.1208 C=CCOC(=O)CSc1c[nH]ccc1=S 62a_100000033060_200012280681 [0,1,0,0,0,0|1,1,0]=3 2475 B15R1.1208 C=CCOC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000033060 [0,1,0,0,0,0|1,1,0]=3 2476 B15R1.1208 C=CCOC(=O)CSc1cccc[n+]1C 62a_100000033060_100000212160 [0,1,0,0,0,0|1,1,0]=3 2477 B15R1.1208 C=CCOC(=O)CSc1cccc[n+]1[O-] 62a_100000033060_200000042595 [0,1,0,0,0,0|1,1,0]=3 2478 B15R1.1208 C=CCOC(=O)CSc1ccccc1Br 62a_100000033060_100000695589 [0,1,0,0,0,0|0,1,0]=2 2479 B15R1.1208 C=CCOC(=O)CSc1ccccc1Br 62a_100000695589_100000033060 [0,1,0,0,0,0|0,1,0]=2 2480 B15R1.1208 C=CCOC(=O)CSc1ccccc1C 62a_100000033060_100000210755 [0,1,0,0,0,0|0,1,0]=2 2481 B15R1.1208 C=CCOC(=O)CSc1ccccc1C 62a_100000210755_100000033060 [0,1,0,0,0,0|0,1,0]=2 2482 B15R1.1208 C=CCOC(=O)CSc1ccccc1Cl 62a_100000033060_100000764095 [0,1,0,0,0,0|0,1,0]=2 2483 B15R1.1208 C=CCOC(=O)CSc1ccccc1Cl 62a_100000764095_100000033060 [0,1,0,0,0,0|0,1,0]=2 2484 B15R1.1208 C=CCOC(=O)CSc1ccccc1F 62a_100000033060_100011215700 [0,1,0,0,0,0|0,1,0]=2 2485 B15R1.1208 C=CCOC(=O)CSc1ccccc1F 62a_100011215700_100000033060 [0,1,0,0,0,0|0,1,0]=2 2486 B15R1.1208 C=CCOC(=O)CSc1ccccc1N 62a_100000033060_100000210017 [0,1,0,0,0,0|0,1,0]=2 2487 B15R1.1208 C=CCOC(=O)CSc1ccccc1N 62a_100000210017_100000033060 [0,1,0,0,0,0|0,1,0]=2 2488 B15R1.1208 C=CCOC(=O)CSc1ccccc1O 62a_100000033060_100000739446 [0,1,0,0,0,0|0,1,0]=2 2489 B15R1.1208 C=CCOC(=O)CSc1ccccc1O 62a_100000739446_100000033060 [0,1,0,0,0,0|0,1,0]=2 2490 B15R1.1208 C=CCOC(=O)CSc1cccnc1Br 62a_100000033060_100010202626 [0,1,0,0,0,0|1,1,0]=3 2491 B15R1.1208 C=CCOC(=O)CSc1cccnc1Br 62a_100010202626_100000033060 [0,1,0,0,0,0|1,1,0]=3 2492 B15R1.1208 C=CCOC(=O)CSc1cccnc1C 62a_100000033060_100000751574 [0,1,0,0,0,0|1,1,0]=3 2493 B15R1.1208 C=CCOC(=O)CSc1cccnc1C 62a_100000751574_100000033060 [0,1,0,0,0,0|1,1,0]=3 2494 B15R1.1208 C=CCOC(=O)CSc1cccnc1Cl 62a_100000033060_100000036424 [0,1,0,0,0,0|1,1,0]=3 2495 B15R1.1208 C=CCOC(=O)CSc1cccnc1Cl 62a_100000036424_100000033060 [0,1,0,0,0,0|1,1,0]=3 2496 B15R1.1208 C=CCOC(=O)CSc1cccnc1F 62a_100000033060_100009816115 [0,1,0,0,0,0|1,1,0]=3 2497 B15R1.1208 C=CCOC(=O)CSc1cccnc1F 62a_100009816115_100000033060 [0,1,0,0,0,0|1,1,0]=3 2498 B15R1.1208 C=CCOC(=O)CSc1cccnc1N 62a_100000033060_100000045569 [0,1,0,0,0,0|1,1,0]=3 2499 B15R1.1208 C=CCOC(=O)CSc1cccnc1N 62a_100000045569_100000033060 [0,1,0,0,0,0|1,1,0]=3 2500 B15R1.1208 C=CCOC(=O)CSc1cccnc1O 62a_100000033060_100000760158 [0,1,0,0,0,0|1,1,0]=3 2501 B15R1.1208 C=CCOC(=O)CSc1cccnc1O 62a_100000760158_100000033060 [0,1,0,0,0,0|1,1,0]=3 2502 B15R1.1208 C=CCOC(=O)CSc1ccn[nH]c1=O 62a_100000033060_100000087129 [0,1,0,0,0,0|2,1,0]=4 2503 B15R1.1208 C=CCOC(=O)CSc1ccncc1Br 62a_100000033060_100000726257 [0,1,0,0,0,0|1,1,0]=3 2504 B15R1.1208 C=CCOC(=O)CSc1ccncc1Br 62a_100000726257_100000033060 [0,1,0,0,0,0|1,1,0]=3 2505 B15R1.1208 C=CCOC(=O)CSc1ccncc1C 62a_100000033060_100000765111 [0,1,0,0,0,0|1,1,0]=3 2506 B15R1.1208 C=CCOC(=O)CSc1ccncc1C 62a_100000765111_100000033060 [0,1,0,0,0,0|1,1,0]=3 2507 B15R1.1208 C=CCOC(=O)CSc1ccncc1Cl 62a_100000033060_100000708259 [0,1,0,0,0,0|1,1,0]=3 2508 B15R1.1208 C=CCOC(=O)CSc1ccncc1Cl 62a_100000708259_100000033060 [0,1,0,0,0,0|1,1,0]=3 2509 B15R1.1208 C=CCOC(=O)CSc1ccncc1F 62a_100000033060_100000047030 [0,1,0,0,0,0|1,1,0]=3 2510 B15R1.1208 C=CCOC(=O)CSc1ccncc1F 62a_100000047030_100000033060 [0,1,0,0,0,0|1,1,0]=3 2511 B15R1.1208 C=CCOC(=O)CSc1ccncc1N 62a_100000033060_100000756074 [0,1,0,0,0,0|1,1,0]=3 2512 B15R1.1208 C=CCOC(=O)CSc1ccncc1N 62a_100000756074_100000033060 [0,1,0,0,0,0|1,1,0]=3 2513 B15R1.1208 C=CCOC(=O)CSc1ccncc1O 62a_100000033060_100009817591 [0,1,0,0,0,0|1,1,0]=3 2514 B15R1.1208 C=CCOC(=O)CSc1ccncc1O 62a_100009817591_100000033060 [0,1,0,0,0,0|1,1,0]=3 2515 B15R1.1208 C=CCOC(=O)CSc1cnccc1Br 62a_100000033060_100010138639 [0,1,0,0,0,0|1,1,0]=3 2516 B15R1.1208 C=CCOC(=O)CSc1cnccc1Br 62a_100010138639_100000033060 [0,1,0,0,0,0|1,1,0]=3 2517 B15R1.1208 C=CCOC(=O)CSc1cnccc1C 62a_100000033060_100000761580 [0,1,0,0,0,0|1,1,0]=3 2518 B15R1.1208 C=CCOC(=O)CSc1cnccc1C 62a_100000761580_100000033060 [0,1,0,0,0,0|1,1,0]=3 2519 B15R1.1208 C=CCOC(=O)CSc1cnccc1Cl 62a_100000033060_100009995489 [0,1,0,0,0,0|1,1,0]=3 2520 B15R1.1208 C=CCOC(=O)CSc1cnccc1Cl 62a_100009995489_100000033060 [0,1,0,0,0,0|1,1,0]=3 2521 B15R1.1208 C=CCOC(=O)CSc1cnccc1F 62a_100000033060_100009820683 [0,1,0,0,0,0|1,1,0]=3 2522 B15R1.1208 C=CCOC(=O)CSc1cnccc1F 62a_100009820683_100000033060 [0,1,0,0,0,0|1,1,0]=3 2523 B15R1.1208 C=CCOC(=O)CSc1cnccc1N 62a_100000033060_100000047001 [0,1,0,0,0,0|1,1,0]=3 2524 B15R1.1208 C=CCOC(=O)CSc1cnccc1N 62a_100000047001_100000033060 [0,1,0,0,0,0|1,1,0]=3 2525 B15R1.1208 C=CCOC(=O)CSc1cncnc1Br 62a_100000033060_200012461658 [0,1,0,0,0,0|2,1,0]=4 2526 B15R1.1208 C=CCOC(=O)CSc1cncnc1Br 62a_200012461658_100000033060 [0,1,0,0,0,0|2,1,0]=4 2527 B15R1.1208 C=CCOC(=O)CSc1cncnc1C 62a_100000033060_100009819671 [0,1,0,0,0,0|2,1,0]=4 2528 B15R1.1208 C=CCOC(=O)CSc1cncnc1C 62a_100009819671_100000033060 [0,1,0,0,0,0|2,1,0]=4 2529 B15R1.1208 C=CCOC(=O)CSc1cncnc1Cl 62a_100000033060_100000758962 [0,1,0,0,0,0|2,1,0]=4 2530 B15R1.1208 C=CCOC(=O)CSc1cncnc1Cl 62a_100000758962_100000033060 [0,1,0,0,0,0|2,1,0]=4 2531 B15R1.1208 C=CCOC(=O)CSc1cncnc1N 62a_100000033060_100011996079 [0,1,0,0,0,0|2,1,0]=4 2532 B15R1.1208 C=CCOC(=O)CSc1cncnc1N 62a_100011996079_100000033060 [0,1,0,0,0,0|2,1,0]=4 2533 B15R1.1208 C=CCOC(=O)CSc1cncnc1O 62a_100000033060_100000751107 [0,1,0,0,0,0|2,1,0]=4 2534 B15R1.1208 C=CCOC(=O)CSc1cncnc1O 62a_100000751107_100000033060 [0,1,0,0,0,0|2,1,0]=4 2535 B15R1.1208 C=CCOC(=O)CSc1cnncc1N 62a_100000033060_100009829405 [0,1,0,0,0,0|2,1,0]=4 2536 B15R1.1208 C=CCOC(=O)CSc1cnncc1N 62a_100009829405_100000033060 [0,1,0,0,0,0|2,1,0]=4 2537 B15R1.1208 C=CCOC(=O)CSc1ncc[nH]c1=O 62a_100000033060_100000763361 [0,1,0,0,0,0|2,1,0]=4 2538 B15R1.1208 C=CCOC(=O)CSc1ncccc1Br 62a_100000033060_100000696092 [0,1,0,0,0,0|1,1,0]=3 2539 B15R1.1208 C=CCOC(=O)CSc1ncccc1Br 62a_100000696092_100000033060 [0,1,0,0,0,0|1,1,0]=3 2540 B15R1.1208 C=CCOC(=O)CSc1ncccc1C 62a_100000033060_100000751373 [0,1,0,0,0,0|1,1,0]=3 2541 B15R1.1208 C=CCOC(=O)CSc1ncccc1C 62a_100000751373_100000033060 [0,1,0,0,0,0|1,1,0]=3 2542 B15R1.1208 C=CCOC(=O)CSc1ncccc1Cl 62a_100000033060_100011356963 [0,1,0,0,0,0|1,1,0]=3 2543 B15R1.1208 C=CCOC(=O)CSc1ncccc1Cl 62a_100011356963_100000033060 [0,1,0,0,0,0|1,1,0]=3 2544 B15R1.1208 C=CCOC(=O)CSc1ncccc1F 62a_100000033060_100000685392 [0,1,0,0,0,0|1,1,0]=3 2545 B15R1.1208 C=CCOC(=O)CSc1ncccc1F 62a_100000685392_100000033060 [0,1,0,0,0,0|1,1,0]=3 2546 B15R1.1208 C=CCOC(=O)CSc1ncccc1N 62a_100000033060_100000688686 [0,1,0,0,0,0|1,1,0]=3 2547 B15R1.1208 C=CCOC(=O)CSc1ncccc1N 62a_100000688686_100000033060 [0,1,0,0,0,0|1,1,0]=3 2548 B15R1.1208 C=CCOC(=O)CSc1ncccc1O 62a_100000033060_100000034122 [0,1,0,0,0,0|1,1,0]=3 2549 B15R1.1208 C=CCOC(=O)CSc1ncccc1O 62a_100000034122_100000033060 [0,1,0,0,0,0|1,1,0]=3 2550 B15R1.1208 C=CCOC(=O)CSc1nccnc1C 62a_100000033060_100011999405 [0,1,0,0,0,0|2,1,0]=4 2551 B15R1.1208 C=CCOC(=O)CSc1nccnc1C 62a_100011999405_100000033060 [0,1,0,0,0,0|2,1,0]=4 2552 B15R1.1208 C=CCOC(=O)CSc1nccnc1Cl 62a_100000033060_100010886584 [0,1,0,0,0,0|2,1,0]=4 2553 B15R1.1208 C=CCOC(=O)CSc1nccnc1Cl 62a_100010886584_100000033060 [0,1,0,0,0,0|2,1,0]=4 2554 B15R1.1208 C=CCOC(=O)CSc1nccnc1F 62a_100000033060_200010125657 [0,1,0,0,0,0|2,1,0]=4 2555 B15R1.1208 C=CCOC(=O)CSc1nccnc1F 62a_200010125657_100000033060 [0,1,0,0,0,0|2,1,0]=4 2556 B15R1.1208 C=CCOC(=O)CSc1nccnc1N 62a_100000033060_100000747729 [0,1,0,0,0,0|2,1,0]=4 2557 B15R1.1208 C=CCOC(=O)CSc1nccnc1N 62a_100000747729_100000033060 [0,1,0,0,0,0|2,1,0]=4 2558 B15R1.1208 C=CCOC(=O)CSc1ncncc1C 62a_100000033060_100011998708 [0,1,0,0,0,0|2,1,0]=4 2559 B15R1.1208 C=CCOC(=O)CSc1ncncc1C 62a_100011998708_100000033060 [0,1,0,0,0,0|2,1,0]=4 2560 B15R1.1208 C=CCOC(=O)CSc1ncncc1F 62a_100000033060_100000069762 [0,1,0,0,0,0|2,1,0]=4 2561 B15R1.1208 C=CCOC(=O)CSc1ncncc1F 62a_100000069762_100000033060 [0,1,0,0,0,0|2,1,0]=4 2562 B15R1.1208 C=CCOC(=O)CSc1ncncc1N 62a_100000033060_100000709731 [0,1,0,0,0,0|2,1,0]=4 2563 B15R1.1208 C=CCOC(=O)CSc1ncncc1N 62a_100000709731_100000033060 [0,1,0,0,0,0|2,1,0]=4 2564 B15R1.1208 C=CCOC(=O)CSc1nnccc1C 62a_100000033060_100000089043 [0,1,0,0,0,0|2,1,0]=4 2565 B15R1.1208 C=CCOC(C)COc1ccccc1C 34a_200011217337_100015514636 [0,1,0,0,0,0|1,0,1]=3 2566 B15R1.1208 C=CCOC(C)COc1ccccc1C 7a_200011217337_100015514636 [0,1,0,0,0,0|1,0,1]=3 2567 B15R1.1208 CC=CCC(=O)COc1ccccc1Br 1458a_100000216496_100000070051 [0,1,0,0,0,0|1,0,2]=4 2568 B15R1.1208 CC=CCC(=O)COc1ccccc1C 1458a_100000182418_100000070051 [0,1,0,0,0,0|1,0,2]=4 2569 B15R1.1208 CC=CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000070051 [0,1,0,0,0,0|1,0,2]=4 2570 B15R1.1208 CC=CCC(=O)COc1ccccc1F 1458a_100000182486_100000070051 [0,1,0,0,0,0|1,0,2]=4 2571 B15R1.1208 CC=CCC(=O)COc1ccccc1O 1458a_100000183020_100000070051 [0,1,0,0,0,0|1,0,2]=4 2572 B15R1.1208 CC=NNC(=O)COc1ccccc1Br 4a_100025785231_200000210099 [0,1,0,0,0,0|2,0,1]=4 2573 B15R1.1208 CC=NNC(=O)COc1ccccc1C 4a_200000182992_200000210099 [0,1,0,0,0,0|2,0,1]=4 2574 B15R1.1208 CC=NNC(=O)COc1ccccc1Cl 4a_100000182942_200000210099 [0,1,0,0,0,0|2,0,1]=4 2575 B15R1.1208 CC=NNC(=O)COc1ccccc1F 4a_100000182485_200000210099 [0,1,0,0,0,0|2,0,1]=4 2576 B15R1.1208 CCCCC(=O)COc1ccccc1Br 1458a_100000216496_100000210211 [0,1,0,0,0,0|1,0,2]=4 2577 B15R1.1208 CCCCC(=O)COc1ccccc1C 1458a_100000182418_100000210211 [0,1,0,0,0,0|1,0,2]=4 2578 B15R1.1208 CCCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210211 [0,1,0,0,0,0|1,0,2]=4 2579 B15R1.1208 CCCCC(=O)COc1ccccc1F 1458a_100000182486_100000210211 [0,1,0,0,0,0|1,0,2]=4 2580 B15R1.1208 CCCCC(=O)COc1ccccc1O 1458a_100000183020_100000210211 [0,1,0,0,0,0|1,0,2]=4 2581 B15R1.1208 CCCNC(=O)COc1ccccc1Br 11a_100020643023_100000216496 [0,1,0,0,0,0|1,0,2]=4 2582 B15R1.1208 CCCNC(=O)COc1ccccc1Br 1626a_100020643023_100000216496 [0,1,0,0,0,0|1,0,2]=4 2583 B15R1.1208 CCCNC(=O)COc1ccccc1Br 240690a_100020643023_100000216496 [0,1,0,0,0,0|1,0,2]=4 2584 B15R1.1208 CCCNC(=O)COc1ccccc1Br 34a_100000181306_100000183358 [0,1,0,0,0,0|1,0,2]=4 2585 B15R1.1208 CCCNC(=O)COc1ccccc1Br 527a_100020643023_100000216496 [0,1,0,0,0,0|1,0,2]=4 2586 B15R1.1208 CCCNC(=O)COc1ccccc1Br 7a_100000181306_100000183358 [0,1,0,0,0,0|1,0,2]=4 2587 B15R1.1208 CCCNC(=O)COc1ccccc1C 11a_100020643023_100000182418 [0,1,0,0,0,0|1,0,2]=4 2588 B15R1.1208 CCCNC(=O)COc1ccccc1C 1626a_100020643023_100000182418 [0,1,0,0,0,0|1,0,2]=4 2589 B15R1.1208 CCCNC(=O)COc1ccccc1C 240690a_100020643023_100000182418 [0,1,0,0,0,0|1,0,2]=4 2590 B15R1.1208 CCCNC(=O)COc1ccccc1C 34a_100000210338_100000183358 [0,1,0,0,0,0|1,0,2]=4 2591 B15R1.1208 CCCNC(=O)COc1ccccc1C 527a_100020643023_100000182418 [0,1,0,0,0,0|1,0,2]=4 2592 B15R1.1208 CCCNC(=O)COc1ccccc1C 7a_100000210338_100000183358 [0,1,0,0,0,0|1,0,2]=4 2593 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 11a_100020643023_100000185159 [0,1,0,0,0,0|1,0,2]=4 2594 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 1626a_100020643023_100000185159 [0,1,0,0,0,0|1,0,2]=4 2595 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 240690a_100020643023_100000185159 [0,1,0,0,0,0|1,0,2]=4 2596 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 34a_100000210172_100000183358 [0,1,0,0,0,0|1,0,2]=4 2597 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 527a_100020643023_100000185159 [0,1,0,0,0,0|1,0,2]=4 2598 B15R1.1208 CCCNC(=O)COc1ccccc1Cl 7a_100000210172_100000183358 [0,1,0,0,0,0|1,0,2]=4 2599 B15R1.1208 CCCNC(=O)COc1ccccc1F 11a_100020643023_100000182486 [0,1,0,0,0,0|1,0,2]=4 2600 B15R1.1208 CCCNC(=O)COc1ccccc1F 1626a_100020643023_100000182486 [0,1,0,0,0,0|1,0,2]=4 2601 B15R1.1208 CCCNC(=O)COc1ccccc1F 240690a_100020643023_100000182486 [0,1,0,0,0,0|1,0,2]=4 2602 B15R1.1208 CCCNC(=O)COc1ccccc1F 34a_100000210171_100000183358 [0,1,0,0,0,0|1,0,2]=4 2603 B15R1.1208 CCCNC(=O)COc1ccccc1F 527a_100020643023_100000182486 [0,1,0,0,0,0|1,0,2]=4 2604 B15R1.1208 CCCNC(=O)COc1ccccc1F 7a_100000210171_100000183358 [0,1,0,0,0,0|1,0,2]=4 2605 B15R1.1208 CCCNC(=O)COc1ccccc1I 34a_100000739446_100000183358 [0,1,0,0,0,0|1,0,2]=4 2606 B15R1.1208 CCCNC(=O)COc1ccccc1I 7a_100000739446_100000183358 [0,1,0,0,0,0|1,0,2]=4 2607 B15R1.1208 CCCNC(=O)COc1ccccc1N 34a_100000185747_100000183358 [0,1,0,0,0,0|1,0,2]=4 2608 B15R1.1208 CCCNC(=O)COc1ccccc1N 7a_100000185747_100000183358 [0,1,0,0,0,0|1,0,2]=4 2609 B15R1.1208 CCCNC(=O)COc1ccccc1O 240690a_100020643023_100000183020 [0,1,0,0,0,0|1,0,2]=4 2610 B15R1.1208 CCCNC(=O)COc1ccccc1O 527a_100020643023_100000183020 [0,1,0,0,0,0|1,0,2]=4 2611 B15R1.1208 CCCOC(=O)CNc1ccccc1Br 34a_100000210017_200011215008 [0,1,0,0,0,0|1,0,2]=4 2612 B15R1.1208 CCCOC(=O)CNc1ccccc1C 34a_100015192222_200011215008 [0,1,0,0,0,0|1,0,2]=4 2613 B15R1.1208 CCCOC(=O)CNc1ccccc1Cl 34a_100000185783_200011215008 [0,1,0,0,0,0|1,0,2]=4 2614 B15R1.1208 CCCOC(=O)CNc1ccccc1F 34a_100000210422_200011215008 [0,1,0,0,0,0|1,0,2]=4 2615 B15R1.1208 CCCOC(=O)CNc1ccccc1I 34a_100000210053_200011215008 [0,1,0,0,0,0|1,0,2]=4 2616 B15R1.1208 CCCOC(=O)CNc1ccccc1O 34a_100000185747_200011215008 [0,1,0,0,0,0|1,0,2]=4 2617 B15R1.1208 CCCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_200011215008 [0,1,0,0,0,0|1,0,2]=4 2618 B15R1.1208 CCCOC(=O)COc1ccccc1Br 34a_100000181306_200011215008 [0,1,0,0,0,0|0,0,2]=3 2619 B15R1.1208 CCCOC(=O)COc1ccccc1Br 7a_100000181306_200011215008 [0,1,0,0,0,0|0,0,2]=3 2620 B15R1.1208 CCCOC(=O)COc1ccccc1C 34a_100000210338_200011215008 [0,1,0,0,0,0|0,0,2]=3 2621 B15R1.1208 CCCOC(=O)COc1ccccc1C 7a_100000210338_200011215008 [0,1,0,0,0,0|0,0,2]=3 2622 B15R1.1208 CCCOC(=O)COc1ccccc1Cl 34a_100000210172_200011215008 [0,1,0,0,0,0|0,0,2]=3 2623 B15R1.1208 CCCOC(=O)COc1ccccc1Cl 7a_100000210172_200011215008 [0,1,0,0,0,0|0,0,2]=3 2624 B15R1.1208 CCCOC(=O)COc1ccccc1F 34a_100000210171_200011215008 [0,1,0,0,0,0|0,0,2]=3 2625 B15R1.1208 CCCOC(=O)COc1ccccc1F 7a_100000210171_200011215008 [0,1,0,0,0,0|0,0,2]=3 2626 B15R1.1208 CCCOC(=O)COc1ccccc1I 34a_100000739446_200011215008 [0,1,0,0,0,0|0,0,2]=3 2627 B15R1.1208 CCCOC(=O)COc1ccccc1I 7a_100000739446_200011215008 [0,1,0,0,0,0|0,0,2]=3 2628 B15R1.1208 CCCOC(=O)COc1ccccc1N 34a_100000185747_200011215008 [0,1,0,0,0,0|0,0,2]=3 2629 B15R1.1208 CCCOC(=O)COc1ccccc1N 7a_100000185747_200011215008 [0,1,0,0,0,0|0,0,2]=3 2630 B15R1.1208 CCCOC(=O)COc1cccnc1Br 34a_100000744436_200011215008 [0,1,0,0,0,0|1,0,2]=4 2631 B15R1.1208 CCCOC(=O)COc1cccnc1Br 7a_100000744436_200011215008 [0,1,0,0,0,0|1,0,2]=4 2632 B15R1.1208 CCCOC(=O)COc1cccnc1C 34a_100000745507_200011215008 [0,1,0,0,0,0|1,0,2]=4 2633 B15R1.1208 CCCOC(=O)COc1cccnc1C 7a_100000745507_200011215008 [0,1,0,0,0,0|1,0,2]=4 2634 B15R1.1208 CCCOC(=O)COc1cccnc1Cl 34a_100000757616_200011215008 [0,1,0,0,0,0|1,0,2]=4 2635 B15R1.1208 CCCOC(=O)COc1cccnc1Cl 7a_100000757616_200011215008 [0,1,0,0,0,0|1,0,2]=4 2636 B15R1.1208 CCCOC(=O)COc1cccnc1F 34a_100000061740_200011215008 [0,1,0,0,0,0|1,0,2]=4 2637 B15R1.1208 CCCOC(=O)COc1cccnc1F 7a_100000061740_200011215008 [0,1,0,0,0,0|1,0,2]=4 2638 B15R1.1208 CCCOC(=O)COc1cccnc1I 34a_100000034122_200011215008 [0,1,0,0,0,0|1,0,2]=4 2639 B15R1.1208 CCCOC(=O)COc1cccnc1I 7a_100000034122_200011215008 [0,1,0,0,0,0|1,0,2]=4 2640 B15R1.1208 CCCOC(=O)COc1cccnc1N 34a_100000211975_200011215008 [0,1,0,0,0,0|1,0,2]=4 2641 B15R1.1208 CCCOC(=O)COc1cccnc1N 7a_100000211975_200011215008 [0,1,0,0,0,0|1,0,2]=4 2642 B15R1.1208 CCCOC(=O)COc1cccoc1=O 34a_100000077404_200011215008 [0,1,0,0,0,0|1,0,2]=4 2643 B15R1.1208 CCCOC(=O)COc1cccoc1=O 7a_100000077404_200011215008 [0,1,0,0,0,0|1,0,2]=4 2644 B15R1.1208 CCCOC(=O)COc1ccncc1Br 34a_100011996408_200011215008 [0,1,0,0,0,0|1,0,2]=4 2645 B15R1.1208 CCCOC(=O)COc1ccncc1C 34a_100000694293_200011215008 [0,1,0,0,0,0|1,0,2]=4 2646 B15R1.1208 CCCOC(=O)COc1ccncc1Cl 34a_100011997054_200011215008 [0,1,0,0,0,0|1,0,2]=4 2647 B15R1.1208 CCCOC(=O)COc1ccncc1F 34a_200000081243_200011215008 [0,1,0,0,0,0|1,0,2]=4 2648 B15R1.1208 CCCOC(=O)COc1cnccc1C 34a_100011997053_200011215008 [0,1,0,0,0,0|1,0,2]=4 2649 B15R1.1208 CCCOC(=O)COc1cnccc1C 7a_100011997053_200011215008 [0,1,0,0,0,0|1,0,2]=4 2650 B15R1.1208 CCCOC(=O)COc1cnccc1Cl 34a_100011996695_200011215008 [0,1,0,0,0,0|1,0,2]=4 2651 B15R1.1208 CCCOC(=O)COc1cnccc1I 34a_100000050107_200011215008 [0,1,0,0,0,0|1,0,2]=4 2652 B15R1.1208 CCCOC(=O)COc1cnccc1N 34a_100000753702_200011215008 [0,1,0,0,0,0|1,0,2]=4 2653 B15R1.1208 CCCOC(=O)COc1coccc1=O 34a_100000060831_200011215008 [0,1,0,0,0,0|1,0,2]=4 2654 B15R1.1208 CCCOC(=O)COc1ncccc1Cl 34a_100011290957_200011215008 [0,1,0,0,0,0|1,0,2]=4 2655 B15R1.1208 CCCOC(=O)COc1ncccc1F 34a_100011219419_200011215008 [0,1,0,0,0,0|1,0,2]=4 2656 B15R1.1208 CCCOC(=O)COc1ncccc1N 34a_100000746358_200011215008 [0,1,0,0,0,0|1,0,2]=4 2657 B15R1.1208 CCCOC(=O)CSc1ccccc1Br 62a_100000695589_200011215008 [0,1,0,0,0,0|0,1,2]=4 2658 B15R1.1208 CCCOC(=O)CSc1ccccc1Br 62a_200011215008_100000695589 [0,1,0,0,0,0|0,1,2]=4 2659 B15R1.1208 CCCOC(=O)CSc1ccccc1C 62a_100000210755_200011215008 [0,1,0,0,0,0|0,1,2]=4 2660 B15R1.1208 CCCOC(=O)CSc1ccccc1C 62a_200011215008_100000210755 [0,1,0,0,0,0|0,1,2]=4 2661 B15R1.1208 CCCOC(=O)CSc1ccccc1Cl 62a_100000764095_200011215008 [0,1,0,0,0,0|0,1,2]=4 2662 B15R1.1208 CCCOC(=O)CSc1ccccc1Cl 62a_200011215008_100000764095 [0,1,0,0,0,0|0,1,2]=4 2663 B15R1.1208 CCCOC(=O)CSc1ccccc1F 62a_100011215700_200011215008 [0,1,0,0,0,0|0,1,2]=4 2664 B15R1.1208 CCCOC(=O)CSc1ccccc1F 62a_200011215008_100011215700 [0,1,0,0,0,0|0,1,2]=4 2665 B15R1.1208 CCCOC(=O)CSc1ccccc1N 62a_100000210017_200011215008 [0,1,0,0,0,0|0,1,2]=4 2666 B15R1.1208 CCCOC(=O)CSc1ccccc1N 62a_200011215008_100000210017 [0,1,0,0,0,0|0,1,2]=4 2667 B15R1.1208 CCCOC(=O)CSc1ccccc1O 62a_100000739446_200011215008 [0,1,0,0,0,0|0,1,2]=4 2668 B15R1.1208 CCCOC(=O)CSc1ccccc1O 62a_200011215008_100000739446 [0,1,0,0,0,0|0,1,2]=4 2669 B15R1.1208 COCCC(=O)COc1ccccc1Br 1458a_100000216496_100000233755 [0,1,0,0,0,0|2,0,1]=4 2670 B15R1.1208 COCCC(=O)COc1ccccc1C 1458a_100000182418_100000233755 [0,1,0,0,0,0|2,0,1]=4 2671 B15R1.1208 COCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000233755 [0,1,0,0,0,0|2,0,1]=4 2672 B15R1.1208 COCCC(=O)COc1ccccc1F 1458a_100000182486_100000233755 [0,1,0,0,0,0|2,0,1]=4 2673 B15R1.1208 COCCC(=O)COc1ccccc1O 1458a_100000183020_100000233755 [0,1,0,0,0,0|2,0,1]=4 2674 B15R1.1208 CSCCC(=O)COc1ccccc1Br 1458a_100000216496_100000751147 [0,1,0,0,0,0|2,0,1]=4 2675 B15R1.1208 CSCCC(=O)COc1ccccc1C 1458a_100000182418_100000751147 [0,1,0,0,0,0|2,0,1]=4 2676 B15R1.1208 CSCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000751147 [0,1,0,0,0,0|2,0,1]=4 2677 B15R1.1208 CSCCC(=O)COc1ccccc1F 1458a_100000182486_100000751147 [0,1,0,0,0,0|2,0,1]=4 2678 B15R1.1208 CSCCC(=O)COc1ccccc1O 1458a_100000183020_100000751147 [0,1,0,0,0,0|2,0,1]=4 2679 B15R1.1208 Cc1ccccc1OCC(=O)CCC#N 1458a_100000182418_100011215226 [0,1,0,0,0,0|2,0,1]=4 2680 B15R1.1208 Cc1ccccc1OCC(=O)CCCF 1458a_100000182418_100011934791 [0,1,0,0,0,0|2,0,1]=4 2681 B15R1.1208 Cc1ccccc1OCC(=O)CCCO 1458a_100000182418_100011215043 [0,1,0,0,0,0|2,0,1]=4 2682 B15R1.1208 Cc1ccccc1OCC(=O)NCC#N 1626a_100000734998_100000182418 [0,1,0,0,0,0|2,0,1]=4 2683 B15R1.1208 Cc1ccccc1OCC(=O)NCC#N 527a_100000734998_100000182418 [0,1,0,0,0,0|2,0,1]=4 2684 B15R1.1208 Cc1ccccc1OCC(=O)NCC#N 7a_100000210338_100000736037 [0,1,0,0,0,0|2,0,1]=4 2685 B15R1.1208 Cc1ccccc1OCC(=O)NCCF 11a_100000724931_100000182418 [0,1,0,0,0,0|2,0,1]=4 2686 B15R1.1208 Cc1ccccc1OCC(=O)NCCF 1626a_100000724931_100000182418 [0,1,0,0,0,0|2,0,1]=4 2687 B15R1.1208 Cc1ccccc1OCC(=O)NCCF 240690a_100000724931_100000182418 [0,1,0,0,0,0|2,0,1]=4 2688 B15R1.1208 Cc1ccccc1OCC(=O)NCCF 527a_100000724931_100000182418 [0,1,0,0,0,0|2,0,1]=4 2689 B15R1.1208 Cc1ccccc1OCC(=O)NCCO 240690a_100000210304_100000182418 [0,1,0,0,0,0|2,0,1]=4 2690 B15R1.1208 Cc1ccccc1OCC(=O)NCCO 527a_100000210304_100000182418 [0,1,0,0,0,0|2,0,1]=4 2691 B15R1.1208 Cc1ccccc1OCC(C)OCC=O 34a_200011217337_200009817547 [0,1,0,0,0,0|2,0,1]=4 2692 B15R1.1208 Cc1ccccc1OCC(C)OCC=O 7a_200011217337_200015260668 [0,1,0,0,0,0|2,0,1]=4 2693 B15R1.1208 N#CCCC(=O)COc1ccccc1Br 1458a_100000216496_100011215226 [0,1,0,0,0,0|2,0,1]=4 2694 B15R1.1208 N#CCCC(=O)COc1ccccc1Cl 1458a_100000185159_100011215226 [0,1,0,0,0,0|2,0,1]=4 2695 B15R1.1208 N#CCCC(=O)COc1ccccc1F 1458a_100000182486_100011215226 [0,1,0,0,0,0|2,0,1]=4 2696 B15R1.1208 N#CCCC(=O)COc1ccccc1O 1458a_100000183020_100011215226 [0,1,0,0,0,0|2,0,1]=4 2697 B15R1.1208 N#CCNC(=O)COc1ccccc1Br 1626a_100000734998_100000216496 [0,1,0,0,0,0|2,0,1]=4 2698 B15R1.1208 N#CCNC(=O)COc1ccccc1Br 527a_100000734998_100000216496 [0,1,0,0,0,0|2,0,1]=4 2699 B15R1.1208 N#CCNC(=O)COc1ccccc1Br 7a_100000181306_100000736037 [0,1,0,0,0,0|2,0,1]=4 2700 B15R1.1208 N#CCNC(=O)COc1ccccc1Cl 1626a_100000734998_100000185159 [0,1,0,0,0,0|2,0,1]=4 2701 B15R1.1208 N#CCNC(=O)COc1ccccc1Cl 527a_100000734998_100000185159 [0,1,0,0,0,0|2,0,1]=4 2702 B15R1.1208 N#CCNC(=O)COc1ccccc1Cl 7a_100000210172_100000736037 [0,1,0,0,0,0|2,0,1]=4 2703 B15R1.1208 N#CCNC(=O)COc1ccccc1F 1626a_100000734998_100000182486 [0,1,0,0,0,0|2,0,1]=4 2704 B15R1.1208 N#CCNC(=O)COc1ccccc1F 527a_100000734998_100000182486 [0,1,0,0,0,0|2,0,1]=4 2705 B15R1.1208 N#CCNC(=O)COc1ccccc1F 7a_100000210171_100000736037 [0,1,0,0,0,0|2,0,1]=4 2706 B15R1.1208 N#CCNC(=O)COc1ccccc1I 7a_100000739446_100000736037 [0,1,0,0,0,0|2,0,1]=4 2707 B15R1.1208 N#CCNC(=O)COc1ccccc1N 7a_100000185747_100000736037 [0,1,0,0,0,0|2,0,1]=4 2708 B15R1.1208 N#CCNC(=O)COc1ccccc1O 527a_100000734998_100000183020 [0,1,0,0,0,0|2,0,1]=4 2709 B15R1.1208 O=C(CCCF)COc1ccccc1Br 1458a_100000216496_100011934791 [0,1,0,0,0,0|2,0,1]=4 2710 B15R1.1208 O=C(CCCF)COc1ccccc1Cl 1458a_100000185159_100011934791 [0,1,0,0,0,0|2,0,1]=4 2711 B15R1.1208 O=C(CCCF)COc1ccccc1F 1458a_100000182486_100011934791 [0,1,0,0,0,0|2,0,1]=4 2712 B15R1.1208 O=C(CCCF)COc1ccccc1O 1458a_100000183020_100011934791 [0,1,0,0,0,0|2,0,1]=4 2713 B15R1.1208 O=C(CCCO)COc1ccccc1Br 1458a_100000216496_100011215043 [0,1,0,0,0,0|2,0,1]=4 2714 B15R1.1208 O=C(CCCO)COc1ccccc1Cl 1458a_100000185159_100011215043 [0,1,0,0,0,0|2,0,1]=4 2715 B15R1.1208 O=C(CCCO)COc1ccccc1F 1458a_100000182486_100011215043 [0,1,0,0,0,0|2,0,1]=4 2716 B15R1.1208 O=C(CCCO)COc1ccccc1O 1458a_100000183020_100011215043 [0,1,0,0,0,0|2,0,1]=4 2717 B15R1.1208 O=C(COc1ccccc1Br)NCCF 11a_100000724931_100000216496 [0,1,0,0,0,0|2,0,1]=4 2718 B15R1.1208 O=C(COc1ccccc1Br)NCCF 1626a_100000724931_100000216496 [0,1,0,0,0,0|2,0,1]=4 2719 B15R1.1208 O=C(COc1ccccc1Br)NCCF 240690a_100000724931_100000216496 [0,1,0,0,0,0|2,0,1]=4 2720 B15R1.1208 O=C(COc1ccccc1Br)NCCF 527a_100000724931_100000216496 [0,1,0,0,0,0|2,0,1]=4 2721 B15R1.1208 O=C(COc1ccccc1Br)NCCO 240690a_100000210304_100000216496 [0,1,0,0,0,0|2,0,1]=4 2722 B15R1.1208 O=C(COc1ccccc1Br)NCCO 527a_100000210304_100000216496 [0,1,0,0,0,0|2,0,1]=4 2723 B15R1.1208 O=C(COc1ccccc1Cl)NCCF 11a_100000724931_100000185159 [0,1,0,0,0,0|2,0,1]=4 2724 B15R1.1208 O=C(COc1ccccc1Cl)NCCF 1626a_100000724931_100000185159 [0,1,0,0,0,0|2,0,1]=4 2725 B15R1.1208 O=C(COc1ccccc1Cl)NCCF 240690a_100000724931_100000185159 [0,1,0,0,0,0|2,0,1]=4 2726 B15R1.1208 O=C(COc1ccccc1Cl)NCCF 527a_100000724931_100000185159 [0,1,0,0,0,0|2,0,1]=4 2727 B15R1.1208 O=C(COc1ccccc1Cl)NCCO 240690a_100000210304_100000185159 [0,1,0,0,0,0|2,0,1]=4 2728 B15R1.1208 O=C(COc1ccccc1Cl)NCCO 527a_100000210304_100000185159 [0,1,0,0,0,0|2,0,1]=4 2729 B15R1.1208 O=C(COc1ccccc1F)NCCF 11a_100000724931_100000182486 [0,1,0,0,0,0|2,0,1]=4 2730 B15R1.1208 O=C(COc1ccccc1F)NCCF 1626a_100000724931_100000182486 [0,1,0,0,0,0|2,0,1]=4 2731 B15R1.1208 O=C(COc1ccccc1F)NCCF 240690a_100000724931_100000182486 [0,1,0,0,0,0|2,0,1]=4 2732 B15R1.1208 O=C(COc1ccccc1F)NCCF 527a_100000724931_100000182486 [0,1,0,0,0,0|2,0,1]=4 2733 B15R1.1208 O=C(COc1ccccc1F)NCCO 240690a_100000210304_100000182486 [0,1,0,0,0,0|2,0,1]=4 2734 B15R1.1208 O=C(COc1ccccc1F)NCCO 527a_100000210304_100000182486 [0,1,0,0,0,0|2,0,1]=4 2735 B15R1.1208 O=C(COc1ccccc1O)NCCF 240690a_100000724931_100000183020 [0,1,0,0,0,0|2,0,1]=4 2736 B15R1.1208 O=C(COc1ccccc1O)NCCF 527a_100000724931_100000183020 [0,1,0,0,0,0|2,0,1]=4 2737 B15R1.1208 O=C(COc1ccccc1O)NCCO 240690a_100000210304_100000183020 [0,1,0,0,0,0|2,0,1]=4 2738 B15R1.1208 O=C(COc1ccccc1O)NCCO 527a_100000210304_100000183020 [0,1,0,0,0,0|2,0,1]=4 2739 B15R1.3921 C=CCOC(CN)COc1ccccc1 34a_100000738913_100015514636 [0,1,0,0,0,0|1,0,1]=3 2740 B15R1.3921 NCC(COc1ccccc1)OCC=O 34a_100000738913_200009817547 [0,1,0,0,0,0|2,0,1]=4 2741 B15R1.5919 C=C(C)CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000730704 [0,1,0,0,0,0|2,0,1]=4 2742 B15R1.5919 C=C(C)CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000730704 [0,1,0,0,0,0|2,0,1]=4 2743 B15R1.5919 C=C(C)CCC(=O)CCc1ccccc1 1458a_100000185753_100000730704 [0,1,0,0,0,0|2,0,0]=3 2744 B15R1.5919 C=C(C)CCC(=O)CCc1ccccc1 1458a_200000688413_100000765856 [0,1,0,0,0,0|2,0,0]=3 2745 B15R1.5919 C=C(C)CCC(=O)CCc1ccccn1 1458a_100015195070_100000730704 [0,1,0,0,0,0|3,0,0]=4 2746 B15R1.5919 C=C(C)CCC(=O)CCc1ccccn1 1458a_200000688413_100015183660 [0,1,0,0,0,0|3,0,0]=4 2747 B15R1.5919 C=C(C)CCC(=O)CCc1cccnc1 1458a_100000198484_100000730704 [0,1,0,0,0,0|3,0,0]=4 2748 B15R1.5919 C=C(C)CCC(=O)CCc1cccnc1 1458a_200000688413_200011713674 [0,1,0,0,0,0|3,0,0]=4 2749 B15R1.5919 C=C(C)CCC(=O)CCc1ccncc1 1458a_100011225043_100000730704 [0,1,0,0,0,0|3,0,0]=4 2750 B15R1.5919 C=C(C)CCC(=O)CCc1ccncc1 1458a_200000688413_100000723409 [0,1,0,0,0,0|3,0,0]=4 2751 B15R1.5919 C=C(C)CCC(=O)COc1ccccc1 1458a_100000186222_100000730704 [0,1,0,0,0,0|1,0,0]=2 2752 B15R1.5919 C=C(C)CCC(=O)COc1ccccn1 1458a_100102699861_100000730704 [0,1,0,0,0,0|2,0,0]=3 2753 B15R1.5919 C=C(C)CCC(=O)COc1cccnc1 1458a_100015207166_100000730704 [0,1,0,0,0,0|2,0,0]=3 2754 B15R1.5919 C=C(C)CCC(=O)CSc1ccccc1 1458a_100000211596_100000730704 [0,1,0,0,0,0|1,1,0]=3 2755 B15R1.5919 C=C(C)CCC(=O)CSc1ccccn1 1458a_100000156281_100000730704 [0,1,0,0,0,0|2,1,0]=4 2756 B15R1.5919 C=C(C)CCC(=O)CSc1ccncc1 1458a_100000211328_100000730704 [0,1,0,0,0,0|2,1,0]=4 2757 B15R1.5919 C=C(C)CCC(=O)NCc1ccccc1 11a_100015324214_200000688413 [0,1,0,0,0,0|3,0,0]=4 2758 B15R1.5919 C=C(C)CCC(=O)NCc1ccccc1 1626a_100015324214_200000688413 [0,1,0,0,0,0|3,0,0]=4 2759 B15R1.5919 C=C(C)CCC(=O)NCc1ccccc1 240690a_100015324214_200000688413 [0,1,0,0,0,0|3,0,0]=4 2760 B15R1.5919 C=C(C)CCC(=O)NCc1ccccc1 527a_100015324214_200000688413 [0,1,0,0,0,0|3,0,0]=4 2761 B15R1.5919 C=C(C)CCC(=O)NNc1ccccc1 22a_100015195140_200000688413 [0,1,0,0,0,0|3,0,0]=4 2762 B15R1.5919 C=C(C)CNC(=O)C#Cc1ccccc1 240690a_100000765925_100000736102 [0,1,0,0,0,0|2,0,1]=4 2763 B15R1.5919 C=C(C)CNC(=O)C=Cc1ccccc1 11a_100000765925_100000210462 [0,1,0,0,0,0|2,0,1]=4 2764 B15R1.5919 C=C(C)CNC(=O)C=Cc1ccccc1 1626a_100000765925_100000210462 [0,1,0,0,0,0|2,0,1]=4 2765 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 11a_100000765925_100000185753 [0,1,0,0,0,0|2,0,0]=3 2766 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 1626a_100000765925_100000185753 [0,1,0,0,0,0|2,0,0]=3 2767 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 240690a_100000765925_100000185753 [0,1,0,0,0,0|2,0,0]=3 2768 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 527a_100000765925_100000185753 [0,1,0,0,0,0|2,0,0]=3 2769 B15R1.5919 C=C(C)CNC(=O)CCc1ccccn1 11a_100000765925_100015195070 [0,1,0,0,0,0|3,0,0]=4 2770 B15R1.5919 C=C(C)CNC(=O)CCc1ccccn1 240690a_100000765925_100015195070 [0,1,0,0,0,0|3,0,0]=4 2771 B15R1.5919 C=C(C)CNC(=O)CCc1ccccn1 527a_100000765925_100015195070 [0,1,0,0,0,0|3,0,0]=4 2772 B15R1.5919 C=C(C)CNC(=O)CCc1cccnc1 11a_100000765925_100000198484 [0,1,0,0,0,0|3,0,0]=4 2773 B15R1.5919 C=C(C)CNC(=O)CCc1cccnc1 1626a_100000765925_100000198484 [0,1,0,0,0,0|3,0,0]=4 2774 B15R1.5919 C=C(C)CNC(=O)CCc1cccnc1 240690a_100000765925_100000198484 [0,1,0,0,0,0|3,0,0]=4 2775 B15R1.5919 C=C(C)CNC(=O)CCc1cccnc1 527a_100000765925_100000198484 [0,1,0,0,0,0|3,0,0]=4 2776 B15R1.5919 C=C(C)CNC(=O)CCc1ccncc1 11a_100000765925_100011225043 [0,1,0,0,0,0|3,0,0]=4 2777 B15R1.5919 C=C(C)CNC(=O)CCc1ccncc1 240690a_100000765925_100011225043 [0,1,0,0,0,0|3,0,0]=4 2778 B15R1.5919 C=C(C)CNC(=O)CCc1ccncc1 527a_100000765925_100011225043 [0,1,0,0,0,0|3,0,0]=4 2779 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 11a_100000765925_100000186222 [0,1,0,0,0,0|1,0,0]=2 2780 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 1626a_100000765925_100000186222 [0,1,0,0,0,0|1,0,0]=2 2781 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 240690a_100000765925_100000186222 [0,1,0,0,0,0|1,0,0]=2 2782 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 527a_100000765925_100000186222 [0,1,0,0,0,0|1,0,0]=2 2783 B15R1.5919 C=C(C)CNC(=O)COc1ccccn1 1626a_100000765925_100102699861 [0,1,0,0,0,0|2,0,0]=3 2784 B15R1.5919 C=C(C)CNC(=O)COc1ccccn1 240690a_100000765925_100102699861 [0,1,0,0,0,0|2,0,0]=3 2785 B15R1.5919 C=C(C)CNC(=O)COc1ccccn1 527a_100000765925_100102699861 [0,1,0,0,0,0|2,0,0]=3 2786 B15R1.5919 C=C(C)CNC(=O)COc1cccnc1 11a_100000765925_100015207166 [0,1,0,0,0,0|2,0,0]=3 2787 B15R1.5919 C=C(C)CNC(=O)COc1cccnc1 1626a_100000765925_100015207166 [0,1,0,0,0,0|2,0,0]=3 2788 B15R1.5919 C=C(C)CNC(=O)COc1cccnc1 240690a_100000765925_100015207166 [0,1,0,0,0,0|2,0,0]=3 2789 B15R1.5919 C=C(C)CNC(=O)COc1cccnc1 527a_100000765925_100015207166 [0,1,0,0,0,0|2,0,0]=3 2790 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 11a_100000765925_100000211596 [0,1,0,0,0,0|1,1,0]=3 2791 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 1626a_100000765925_100000211596 [0,1,0,0,0,0|1,1,0]=3 2792 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 240690a_100000765925_100000211596 [0,1,0,0,0,0|1,1,0]=3 2793 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 527a_100000765925_100000211596 [0,1,0,0,0,0|1,1,0]=3 2794 B15R1.5919 C=C(C)CNC(=O)CSc1ccccn1 11a_100000765925_100000156281 [0,1,0,0,0,0|2,1,0]=4 2795 B15R1.5919 C=C(C)CNC(=O)CSc1ccccn1 240690a_100000765925_100000156281 [0,1,0,0,0,0|2,1,0]=4 2796 B15R1.5919 C=C(C)CNC(=O)CSc1ccccn1 527a_100000765925_100000156281 [0,1,0,0,0,0|2,1,0]=4 2797 B15R1.5919 C=C(C)CNC(=O)CSc1ccncc1 11a_100000765925_100000211328 [0,1,0,0,0,0|2,1,0]=4 2798 B15R1.5919 C=C(C)CNC(=O)CSc1ccncc1 1626a_100000765925_100000211328 [0,1,0,0,0,0|2,1,0]=4 2799 B15R1.5919 C=C(C)CNC(=O)CSc1ccncc1 240690a_100000765925_100000211328 [0,1,0,0,0,0|2,1,0]=4 2800 B15R1.5919 C=C(C)CNC(=O)CSc1ccncc1 527a_100000765925_100000211328 [0,1,0,0,0,0|2,1,0]=4 2801 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 2708a_100000765925_100015324214 [0,1,0,0,0,0|3,0,0]=4 2802 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 2708a_100015324214_100000765925 [0,1,0,0,0,0|3,0,0]=4 2803 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 273464a_100000765925_100015324214 [0,1,0,0,0,0|3,0,0]=4 2804 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 273464a_100015324214_100000765925 [0,1,0,0,0,0|3,0,0]=4 2805 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 512a_100000765925_100015324214 [0,1,0,0,0,0|3,0,0]=4 2806 B15R1.5919 C=C(C)CNC(=O)NCc1ccccc1 512a_100015324214_100000765925 [0,1,0,0,0,0|3,0,0]=4 2807 B15R1.5919 C=C(C)CNC(=O)NNc1ccccc1 273464a_100000765925_100015195140 [0,1,0,0,0,0|3,0,0]=4 2808 B15R1.5919 C=C(C)CNC(=O)NNc1ccccc1 512a_100000765925_100015195140 [0,1,0,0,0,0|3,0,0]=4 2809 B15R1.5919 C=C(C)CNC(C)COc1ccccc1 2230a_100000746794_100000748629 [0,1,0,0,0,0|2,0,1]=4 2810 B15R1.5919 C=C(C)CNC(C)COc1ccccc1 34a_100000746794_100000748629 [0,1,0,0,0,0|2,0,1]=4 2811 B15R1.5919 C=C(C)COC(C)COc1ccccc1 34a_100000210911_100000748629 [0,1,0,0,0,0|1,0,1]=3 2812 B15R1.5919 C=C(C)COC(C)COc1ccccc1 7a_100000210911_100000748629 [0,1,0,0,0,0|1,0,1]=3 2813 B15R1.5919 C=C(C)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100000748629 [0,1,0,0,0,0|2,0,1]=4 2814 B15R1.5919 C=C(C)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000748629 [0,1,0,0,0,0|2,0,1]=4 2815 B15R1.5919 C=C(F)CNC(C)COc1ccccc1 2230a_100000746794_100009893438 [0,1,0,0,0,0|2,0,1]=4 2816 B15R1.5919 C=C(F)CNC(C)COc1ccccc1 34a_100000746794_100009893438 [0,1,0,0,0,0|2,0,1]=4 2817 B15R1.5919 C=C(F)COC(C)COc1ccccc1 34a_100000210911_100009893438 [0,1,0,0,0,0|1,0,1]=3 2818 B15R1.5919 C=C(F)COC(C)COc1ccccc1 7a_100000210911_100000042424 [0,1,0,0,0,0|1,0,1]=3 2819 B15R1.5919 C=C(F)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100009893438 [0,1,0,0,0,0|2,0,1]=4 2820 B15R1.5919 C=C(F)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000042424 [0,1,0,0,0,0|2,0,1]=4 2821 B15R1.5919 CC(=CCC(=O)COc1ccccc1)C 1458a_100000186222_100000761012 [0,1,0,0,0,0|1,0,2]=4 2822 B15R1.5919 CC(=O)CNC(=O)CCc1ccccc1 1458a_100000194590_200000210301 [0,1,0,0,0,0|2,0,1]=4 2823 B15R1.5919 CC(=O)CNC(=O)COc1ccccc1 1458a_100000185185_200000210301 [0,1,0,0,0,0|1,0,1]=3 2824 B15R1.5919 CC(=O)NNC(=O)COc1ccccc1 22a_100000186219_100000070787 [0,1,0,0,0,0|2,0,1]=4 2825 B15R1.5919 CC(=O)NNC(=O)COc1ccccc1 22a_100000189765_100000186222 [0,1,0,0,0,0|2,0,1]=4 2826 B15R1.5919 CC(=O)NNC(=O)COc1ccccc1 7a_100000210340_100000181415 [0,1,0,0,0,0|2,0,1]=4 2827 B15R1.5919 CC(=O)OCC(=O)COc1ccccc1 34a_100000210340_100000036994 [0,1,0,0,0,0|2,0,1]=4 2828 B15R1.5919 CC(C)CCC(=O)COc1ccccc1 1458a_100000186222_100000210312 [0,1,0,0,0,0|1,0,2]=4 2829 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 11a_100000210953_100000186222 [0,1,0,0,0,0|1,0,2]=4 2830 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 1626a_100000210953_100000186222 [0,1,0,0,0,0|1,0,2]=4 2831 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 240690a_100000210953_100000186222 [0,1,0,0,0,0|1,0,2]=4 2832 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 34a_100000210340_100000183291 [0,1,0,0,0,0|1,0,2]=4 2833 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 527a_100000210953_100000186222 [0,1,0,0,0,0|1,0,2]=4 2834 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 7a_100000210340_100000183291 [0,1,0,0,0,0|1,0,2]=4 2835 B15R1.5919 CC(COc1ccccc1)OCC(=O)N 34a_100000210911_100000187820 [0,1,0,0,0,0|2,0,1]=4 2836 B15R1.5919 CC(COc1ccccc1)OCC(=O)N 7a_100000210911_100000187820 [0,1,0,0,0,0|2,0,1]=4 2837 B15R1.5919 CC(COc1ccccc1)OCC(=O)[O-] 34a_100000210911_100020667443 [0,1,0,0,0,0|2,0,1]=4 2838 B15R1.5919 CC(O)CCC(=O)COc1ccccc1 1458a_100000186222_100012276601 [0,1,0,0,0,0|1,0,2]=4 2839 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 11a_100000210904_100000186222 [0,1,0,0,0,0|1,0,2]=4 2840 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 240690a_100000210904_100000186222 [0,1,0,0,0,0|1,0,2]=4 2841 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 527a_100000210904_100000186222 [0,1,0,0,0,0|1,0,2]=4 2842 B15R1.5919 NC(=O)CCC(=O)CCc1ccccc1 1458a_100011215257_100000765856 [0,1,0,0,0,0|3,0,0]=4 2843 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 11a_100000711301_100000185753 [0,1,0,0,0,0|3,0,0]=4 2844 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 240690a_100000711301_100000185753 [0,1,0,0,0,0|3,0,0]=4 2845 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 527a_100000711301_100000185753 [0,1,0,0,0,0|3,0,0]=4 2846 B15R1.5919 NC(=O)CNC(=O)COc1ccccc1 11a_100000711301_100000186222 [0,1,0,0,0,0|2,0,0]=3 2847 B15R1.5919 NC(=O)CNC(=O)COc1ccccc1 240690a_100000711301_100000186222 [0,1,0,0,0,0|2,0,0]=3 2848 B15R1.5919 NC(=O)CNC(=O)COc1ccccc1 527a_100000711301_100000186222 [0,1,0,0,0,0|2,0,0]=3 2849 B15R1.5919 NC(=O)CNC(=O)COc1ccccn1 240690a_100000711301_100102699861 [0,1,0,0,0,0|3,0,0]=4 2850 B15R1.5919 NC(=O)CNC(=O)COc1ccccn1 527a_100000711301_100102699861 [0,1,0,0,0,0|3,0,0]=4 2851 B15R1.5919 NC(=O)CNC(=O)COc1cccnc1 11a_100000711301_100015207166 [0,1,0,0,0,0|3,0,0]=4 2852 B15R1.5919 NC(=O)CNC(=O)COc1cccnc1 240690a_100000711301_100015207166 [0,1,0,0,0,0|3,0,0]=4 2853 B15R1.5919 NC(=O)CNC(=O)COc1cccnc1 527a_100000711301_100015207166 [0,1,0,0,0,0|3,0,0]=4 2854 B15R1.5919 NC(=O)CNC(=O)CSc1ccccc1 11a_100000711301_100000211596 [0,1,0,0,0,0|2,1,0]=4 2855 B15R1.5919 NC(=O)CNC(=O)CSc1ccccc1 240690a_100000711301_100000211596 [0,1,0,0,0,0|2,1,0]=4 2856 B15R1.5919 NC(=O)CNC(=O)CSc1ccccc1 527a_100000711301_100000211596 [0,1,0,0,0,0|2,1,0]=4 2857 B15R1.5919 O=C(COc1ccccc1)NCC(F)F 11a_100000765723_100000186222 [0,1,0,0,0,0|2,0,1]=4 2858 B15R1.5919 O=C(COc1ccccc1)NCC(F)F 1626a_100000765723_100000186222 [0,1,0,0,0,0|2,0,1]=4 2859 B15R1.5919 O=C(COc1ccccc1)NCC(F)F 240690a_100000765723_100000186222 [0,1,0,0,0,0|2,0,1]=4 2860 B15R1.5919 O=C(COc1ccccc1)NCC(F)F 527a_100000765723_100000186222 [0,1,0,0,0,0|2,0,1]=4 2861 B15R1.5919 [13CH3]C(=O)CNC(=O)CCc1ccccc1 1458a_100000194590_200025704644 [0,1,0,0,0,0|2,0,1]=4 2862 B15R1.5919 [13CH3]C(=O)CNC(=O)COc1ccccc1 1458a_100000185185_200025704644 [0,1,0,0,0,0|1,0,1]=3 2863 B15R1.5934 C=CCNS(=O)(=O)CCc1ccccc1 270084a_100020586998_100000738789 [0,1,0,0,0,0|3,0,0]=4 2864 B15R1.5934 C=CCNS(=O)(=O)CCc1ccccc1 274078a_100020586998_100000738789 [0,1,0,0,0,0|3,0,0]=4 2865 B15R1.5934 C=CCOC(C)(C)CCc1ccccc1 7a_100000750528_100015514636 [0,1,0,0,0,0|2,0,1]=4 2866 B13R0.66 C=CCOC(=O)COC/C=C/C=C/C 34a_100016283227_100000033060 [0,0,1,0,0,0|0,0,2]=3 2867 B13R0.126 C=CCNC(=O)COC(C=C)CC=C 7a_100000038011_100000183597 [0,0,1,0,0,0|1,0,2]=4 2868 B13R0.126 C=CCOC(=O)COC(C=C)CC=C 34a_100000038011_100000033060 [0,0,1,0,0,0|0,0,2]=3 2869 B13R0.126 C=CCOC(=O)COC(C=C)CC=C 7a_100000038011_100000033060 [0,0,1,0,0,0|0,0,2]=3 2870 B15R2.38 O=C1CCCCC1Oc2ccccc2 34a_100000210340_100000754470 [0,0,0,1,0,0|1,0,2]=4 2871 B15R2.38 O=C1CCCCC1Oc2ccccc2 7a_100000210340_100000204591 [0,0,0,1,0,0|1,0,2]=4 2872 B15R2.38 O=C1CCOCC1Oc2ccccc2 34a_100000210340_100012180262 [0,0,0,1,0,0|2,0,1]=4 2873 B15R2.38 O=C1CCOCC1Oc2ccccc2 7a_100000210340_100012180262 [0,0,0,1,0,0|2,0,1]=4 2874 B15R2.38 O=C1NCCCC1Oc2ccccc2 34a_100000210340_100000687798 [0,0,0,1,0,0|1,0,2]=4 2875 B15R2.38 O=C1NCCCC1Oc2ccccc2 7a_100000210340_100000687798 [0,0,0,1,0,0|1,0,2]=4 2876 B15R2.283 Brc1cc(on1)COc2ccccc2 7a_100000210340_100000709089 [0,0,0,1,0,0|3,0,0]=4 2877 B15R2.283 Cc1cc(on1)COc2ccccc2 34a_100000210340_100000707947 [0,0,0,1,0,0|2,0,1]=4 2878 B15R2.283 Cc1cc(on1)COc2ccccc2 7a_100000210340_100000707947 [0,0,0,1,0,0|2,0,1]=4 2879 B15R2.283 Cc1noc(n1)COc2ccccc2 270196a_100000212224_100000186222 [0,0,0,1,0,0|2,0,1]=4 2880 B15R2.283 Cc1noc(n1)COc2ccccc2 34a_100000210340_100000735555 [0,0,0,1,0,0|2,0,1]=4 2881 B15R2.283 Cc1noc(n1)COc2ccccc2 7a_100000210340_100000735555 [0,0,0,1,0,0|2,0,1]=4 2882 B15R2.352 C=CCNC1COc2ccccc2C1 2230a_100000739546_100000210623 [0,0,0,1,0,0|2,0,1]=4 2883 B15R2.352 C=CCNC1COc2ccccc2C1 270004a_100020586998_100000048293 [0,0,0,1,0,0|2,0,1]=4 2884 B15R2.352 C=CCOC1CCc2ccccc2C1 34a_100011216300_100015514636 [0,0,0,1,0,0|2,0,1]=4 2885 B15R2.352 C=CCOC1CCc2ccccc2C1 7a_100011216300_100015514636 [0,0,0,1,0,0|2,0,1]=4 2886 B15R2.352 C=CCOc1ccc2ccccc2c1 34a_100000185828_100015514636 [0,0,0,1,0,0|2,0,1]=4 2887 B15R2.352 C=CCOc1ccc2ccccc2c1 7a_100000185828_100015514636 [0,0,0,1,0,0|2,0,1]=4 2888 B15R2.352 C=CCOc1cnc2ccccc2c1 34a_100011934006_100015514636 [0,0,0,1,0,0|2,0,1]=4 2889 B15R2.352 C=CCOc1cnc2ccccc2c1 7a_100011934006_100015514636 [0,0,0,1,0,0|2,0,1]=4 2890 B15R2.355 CC1=NNC(=O)C1Oc2ccccc2 7a_100000210340_200009843013 [0,0,0,1,0,0|2,0,1]=4 2891 B15R2.355 O=C1CCC(=O)C1Oc2ccccc2 7a_100000210340_100009820769 [0,0,0,1,0,0|2,0,0]=3 2892 B15R2.355 O=C1CCC(=O)C1Oc2cccnc2 7a_100000210849_100009820769 [0,0,0,1,0,0|3,0,0]=4 2893 B15R2.355 O=C1CCC(=O)C1Sc2ccccc2 62a_100000719477_100009820769 [0,0,0,1,0,0|2,1,0]=4 2894 B15R2.355 O=C1CCC(=O)C1Sc2ccccc2 62a_100009820769_100000041952 [0,0,0,1,0,0|2,1,0]=4 2895 B15R2.355 O=C1COC(=O)C1Nc2ccccc2 34a_100000106764_100000032967 [0,0,0,1,0,0|2,0,0]=3 2896 B15R2.355 O=C1COC(=O)C1Oc2ccccc2 34a_100000210340_100000032967 [0,0,0,1,0,0|1,0,0]=2 2897 B15R2.355 O=C1COC(=O)C1Oc2cccnc2 34a_100000210849_100000032967 [0,0,0,1,0,0|2,0,0]=3 2898 B15R2.355 O=C1COC(=O)C1Oc2ccncc2 34a_100000212176_100000032967 [0,0,0,1,0,0|2,0,0]=3 2899 B15R2.355 O=C1COC(=O)C1Oc2ccnnc2 34a_100015204005_100000032967 [0,0,0,1,0,0|3,0,0]=4 2900 B15R2.355 O=C1COC(=O)C1Sc2ccccc2 62a_100000719477_100000032967 [0,0,0,1,0,0|1,1,0]=3 2901 B15R2.355 O=C1COC(=O)C1Sc2ccccn2 62a_100011216584_100000032967 [0,0,0,1,0,0|2,1,0]=4 2902 B15R2.355 O=C1COC(=O)C1Sc2cccnc2 62a_100000210063_100000032967 [0,0,0,1,0,0|2,1,0]=4 2903 B15R2.355 O=C1COC(=O)C1Sc2ccncc2 62a_100000728582_100000032967 [0,0,0,1,0,0|2,1,0]=4 2904 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [0,0,0,1,0,0|2,0,1]=4 2905 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [0,0,0,1,0,0|2,0,1]=4 2906 B15R2.2195 c1ccc(cc1)OCc2ccccn2 34a_100000210340_100000721315 [0,0,0,1,0,0|2,0,1]=4 2907 B15R2.2195 c1ccc(cc1)OCc2ccccn2 7a_100000210340_100000721315 [0,0,0,1,0,0|2,0,1]=4 2908 B15R2.2195 c1ccc(cc1)OCc2cccnc2 34a_100000210340_100000733263 [0,0,0,1,0,0|3,0,0]=4 2909 B15R2.2195 c1ccc(cc1)OCc2cccnc2 7a_100000210340_100000741622 [0,0,0,1,0,0|3,0,0]=4 2910 B15R2.2195 c1ccc(cc1)OCc2cccnn2 34a_100000210340_100016990269 [0,0,0,1,0,0|3,0,0]=4 2911 B15R2.2195 c1ccc(cc1)OCc2cccnn2 7a_100000210340_100016990269 [0,0,0,1,0,0|3,0,0]=4 2912 B15R2.2195 c1ccc(cc1)OCc2cnccn2 34a_100000210340_100016995436 [0,0,0,1,0,0|3,0,0]=4 2913 B15R2.2195 c1ccc(cc1)OCc2cnccn2 7a_100000210340_100016995436 [0,0,0,1,0,0|3,0,0]=4 2914 B15R2.2195 c1ccc(cc1)OCc2ncccn2 34a_100000210340_100000703007 [0,0,0,1,0,0|2,0,1]=4 2915 B15R2.2195 c1ccc(cc1)OCc2ncccn2 7a_100000210340_100000703007 [0,0,0,1,0,0|2,0,1]=4 2916 B15R2.19653 C=CCOC1(CCc2c1cccc2)C 34a_100000685031_100015514636 [0,0,0,1,0,0|2,0,1]=4 2917 B15R2.19653 C=CCOC1(CCc2c1cccc2)C 7a_100000685031_100015514636 [0,0,0,1,0,0|2,0,1]=4 2918 B15R2.24490 O=C(COc1ccccc1)C2CCC2 1458a_100000186222_100000749161 [0,0,0,1,0,0|1,0,2]=4 2919 B15R2.24490 O=C(COc1ccccc1)C2CCC2 34a_100000210340_100000686122 [0,0,0,1,0,0|1,0,2]=4 2920 B15R2.24490 O=C(COc1ccccc1)C2CCC2 7a_100000210340_100000686122 [0,0,0,1,0,0|1,0,2]=4 2921 B15R2.24490 O=C(COc1ccccc1)C2COC2 1458a_100000186222_100000687716 [0,0,0,1,0,0|2,0,1]=4 2922 B15R2.24490 O=C(COc1ccccc1)N2CCC2 11a_100000754969_100000186222 [0,0,0,1,0,0|1,0,2]=4 2923 B15R2.24490 O=C(COc1ccccc1)N2CCC2 240690a_100000754969_100000186222 [0,0,0,1,0,0|1,0,2]=4 2924 B15R2.24490 O=C(COc1ccccc1)N2CCC2 34a_100000210340_100000185095 [0,0,0,1,0,0|1,0,2]=4 2925 B15R2.24490 O=C(COc1ccccc1)N2CCC2 527a_100000754969_100000186222 [0,0,0,1,0,0|1,0,2]=4 2926 B15R2.24490 O=C(COc1ccccc1)N2CCC2 7a_100000210340_100000185095 [0,0,0,1,0,0|1,0,2]=4 2927 B15R2.24494 O=C(COc1ccccc1)CC2CC2 1458a_100000186222_100000742324 [0,0,0,1,0,0|1,0,2]=4 2928 B15R2.24494 O=C(COc1ccccc1)CC2CO2 1458a_100000186222_100011216344 [0,0,0,1,0,0|2,0,1]=4 2929 B15R2.24494 O=C(COc1ccccc1)CC2CS2 1458a_100000186222_100000031435 [0,0,0,1,0,0|2,0,1]=4 2930 B15R2.24494 O=C(COc1ccccc1)C[C@@H]2CO2 1458a_100000186222_100000745022 [0,0,0,1,0,0|2,0,1]=4 2931 B15R2.24494 O=C(COc1ccccc1)NC2CC2 1626a_100000212008_100000186222 [0,0,0,1,0,0|1,0,2]=4 2932 B15R2.24494 O=C(COc1ccccc1)NC2CC2 240690a_100000212008_100000186222 [0,0,0,1,0,0|1,0,2]=4 2933 B15R2.24494 O=C(COc1ccccc1)NC2CC2 34a_100000210340_100000182950 [0,0,0,1,0,0|1,0,2]=4 2934 B15R2.24494 O=C(COc1ccccc1)NC2CC2 527a_100000212008_100000186222 [0,0,0,1,0,0|1,0,2]=4 2935 B15R2.24494 O=C(COc1ccccc1)NC2CC2 7a_100000210340_100000182950 [0,0,0,1,0,0|1,0,2]=4 2936 B15R2.92869 C=CCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000754431 [0,0,0,1,0,0|2,0,0]=3 2937 B15R2.92869 C=CCNC(=O)C1Cc2c1cccc2 1626a_100020586998_200000238571 [0,0,0,1,0,0|2,0,0]=3 2938 B15R2.92869 C=CCNC(=O)C1Cc2c1cccc2 240690a_100020586998_200000238571 [0,0,0,1,0,0|2,0,0]=3 2939 B15R2.92869 C=CCNC(=O)C1Cc2c1cccc2 527a_100020586998_200000238571 [0,0,0,1,0,0|2,0,0]=3 2940 B13R1.44 C#CCCC(=O)Cc1ccccc1 1458a_100000692101_100015291786 [0,0,0,0,1,0|1,0,2]=4 2941 B13R1.44 C=CC=CC(=O)Cc1ccccc1 1458a_100016291481_100015291786 [0,0,0,0,1,0|1,0,1]=3 2942 B13R1.44 C=CC=CC(=O)Cc1ccccn1 1458a_100016291481_100000721315 [0,0,0,0,1,0|2,0,1]=4 2943 B13R1.44 C=CC=CC(=O)Cc1cccnc1 1458a_100016291481_100000733263 [0,0,0,0,1,0|2,0,1]=4 2944 B13R1.44 C=CC=CC(=O)Cc1ccncc1 1458a_100016291481_100000705612 [0,0,0,0,1,0|2,0,1]=4 2945 B13R1.44 C=CC=CC(=O)Nc1ccccc1 1626a_100000106764_100016291481 [0,0,0,0,1,0|2,0,1]=4 2946 B13R1.44 C=CC=CC(=O)Nc1ccccc1 22a_100000106764_100016291481 [0,0,0,0,1,0|2,0,1]=4 2947 B13R1.44 C=CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000754431 [0,0,0,0,1,0|2,0,0]=3 2948 B13R1.44 C=CCCC(=O)Cc1ccccc1 1458a_100000749702_100015291786 [0,0,0,0,1,0|1,0,0]=2 2949 B13R1.44 C=CCCC(=O)Cc1ccccn1 1458a_100000233486_100000754431 [0,0,0,0,1,0|2,0,0]=3 2950 B13R1.44 C=CCCC(=O)Cc1ccccn1 1458a_100000749702_100000721315 [0,0,0,0,1,0|2,0,0]=3 2951 B13R1.44 C=CCCC(=O)Cc1cccnc1 1458a_100000737805_100000754431 [0,0,0,0,1,0|2,0,0]=3 2952 B13R1.44 C=CCCC(=O)Cc1cccnc1 1458a_100000749702_100000733263 [0,0,0,0,1,0|2,0,0]=3 2953 B13R1.44 C=CCCC(=O)Cc1cccnn1 1458a_100000749702_100016990269 [0,0,0,0,1,0|3,0,0]=4 2954 B13R1.44 C=CCCC(=O)Cc1ccncc1 1458a_100000749702_100000705612 [0,0,0,0,1,0|2,0,0]=3 2955 B13R1.44 C=CCCC(=O)Cc1cnccn1 1458a_100000749702_100016995436 [0,0,0,0,1,0|3,0,0]=4 2956 B13R1.44 C=CCCC(=O)Cc1cncnc1 1458a_100000721575_100000754431 [0,0,0,0,1,0|3,0,0]=4 2957 B13R1.44 C=CCCC(=O)Cc1cncnc1 1458a_100000749702_100015196519 [0,0,0,0,1,0|3,0,0]=4 2958 B13R1.44 C=CCCC(=O)Cc1ncccn1 1458a_100000749702_100000703007 [0,0,0,0,1,0|3,0,0]=4 2959 B13R1.44 C=CCCC(=O)Nc1ccccc1 11a_100000106764_100000749702 [0,0,0,0,1,0|2,0,0]=3 2960 B13R1.44 C=CCCC(=O)Nc1ccccc1 1626a_100000106764_100000749702 [0,0,0,0,1,0|2,0,0]=3 2961 B13R1.44 C=CCCC(=O)Nc1ccccc1 22a_100000106764_100000749702 [0,0,0,0,1,0|2,0,0]=3 2962 B13R1.44 C=CCCC(=O)Nc1ccccc1 527a_100000106764_100000749702 [0,0,0,0,1,0|2,0,0]=3 2963 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100000186898_100000754431 [0,0,0,0,1,0|3,0,0]=4 2964 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100011934112_200000210301 [0,0,0,0,1,0|3,0,0]=4 2965 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100020639649_100015291786 [0,0,0,0,1,0|3,0,0]=4 2966 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100000186898_100000754431 [0,0,0,0,1,0|3,0,0]=4 2967 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100011934112_200000210301 [0,0,0,0,1,0|3,0,0]=4 2968 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100020639649_100000211182 [0,0,0,0,1,0|3,0,0]=4 2969 B13R1.44 C=CCCN(C)Cc1ccccc1 270004a_100020639649_100015611070 [0,0,0,0,1,0|3,0,0]=4 2970 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 2230a_100011934112_200025704644 [0,0,0,0,1,0|3,0,0]=4 2971 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 269982a_100011934112_200025704644 [0,0,0,0,1,0|3,0,0]=4 2972 B13R1.44 C=CCNC(=O)C[n+]1ccccc1 240690a_100020586998_200000086051 [0,0,0,0,1,0|2,0,0]=3 2973 B13R1.44 C=CCNC(=O)C[n+]1ccccc1 527a_100020586998_200000086051 [0,0,0,0,1,0|2,0,0]=3 2974 B13R1.44 C=CCNC(=O)Cc1cccnc1 240690a_100020586998_100000737805 [0,0,0,0,1,0|2,0,0]=3 2975 B13R1.44 C=CCNC(=O)Cc1cccnc1 527a_100020586998_100000737805 [0,0,0,0,1,0|2,0,0]=3 2976 B13R1.44 C=CCNC(=O)Cc1ccncc1 240690a_100020586998_100011201483 [0,0,0,0,1,0|2,0,0]=3 2977 B13R1.44 C=CCNC(=O)Cc1cnccn1 240690a_100020586998_100000726051 [0,0,0,0,1,0|3,0,0]=4 2978 B13R1.44 C=CCNC(=O)Cc1cnccn1 527a_100020586998_100000726051 [0,0,0,0,1,0|3,0,0]=4 2979 B13R1.44 C=CCNC(=O)Cc1cncnc1 240690a_100020586998_100000721575 [0,0,0,0,1,0|3,0,0]=4 2980 B13R1.44 C=CCNC(=O)Cc1cncnc1 527a_100020586998_100000721575 [0,0,0,0,1,0|3,0,0]=4 2981 B13R1.44 C=CCNC(=O)Nc1ccccc1 2430a_100000106764_100020586998 [0,0,0,0,1,0|2,0,0]=3 2982 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_100000748627_100015514636 [0,0,0,0,1,0|1,0,1]=3 2983 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_200000210373_200011218536 [0,0,0,0,1,0|1,0,1]=3 2984 B13R1.44 C=CCOC(C)Cc1ccccc1 7a_100000748627_100015514636 [0,0,0,0,1,0|1,0,1]=3 2985 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_100000210623_200011218536 [0,0,0,0,1,0|1,1,1]=4 2986 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_200011218536_100000210623 [0,0,0,0,1,0|1,1,1]=4 2987 B13R1.44 CC(Cc1ccccc1)OCC=O 34a_100000748627_200009817547 [0,0,0,0,1,0|2,0,1]=4 2988 B13R1.44 CC(Cc1ccccc1)OCC=O 7a_100000748627_200015260668 [0,0,0,0,1,0|2,0,1]=4 2989 B13R1.44 CC=CCC(=O)Cc1ccccc1 1458a_100121576822_100015291786 [0,0,0,0,1,0|1,0,2]=4 2990 B13R1.44 CC=NNC(=O)Cc1ccccc1 4a_100000182964_200000210099 [0,0,0,0,1,0|2,0,1]=4 2991 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [0,0,0,0,1,0|1,0,2]=4 2992 B13R1.44 CNCCC(=O)Oc1ccccc1 2230a_106832991635_200000035796 [0,0,0,0,1,0|2,0,1]=4 2993 B13R1.44 CNCCC(=O)Oc1ccccc1 7a_106832991635_200000035796 [0,0,0,0,1,0|2,0,1]=4 2994 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [0,0,0,0,1,0|2,0,1]=4 2995 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [0,0,0,0,1,0|2,0,1]=4 2996 B13R1.44 CSCCC(=O)Oc1ccccc1 62a_200000210301_200000035796 [0,0,0,0,1,0|2,0,1]=4 2997 B13R1.44 N#CCCC(=O)Cc1ccccc1 1458a_100011934036_100015291786 [0,0,0,0,1,0|2,0,1]=4 2998 B13R1.44 [13CH3]SCCC(=O)Oc1ccccc1 62a_200025704644_200000035796 [0,0,0,0,1,0|2,0,1]=4 2999 B13R1.153 C=CCCC(=O)CCc1cc[nH]c1 1458a_200000093579_100000754431 [0,0,0,0,1,0|3,0,0]=4 3000 B13R1.153 C=CCCC(=O)CCc1ccc[nH]1 1458a_200011998680_100000754431 [0,0,0,0,1,0|3,0,0]=4 3001 B13R1.153 C=CCCC(=O)CCc1ccco1 1458a_100000185103_100000754431 [0,0,0,0,1,0|3,0,0]=4 3002 B13R1.153 C=CCCC(=O)CCc1cccs1 1458a_100000185280_100000754431 [0,0,0,0,1,0|3,0,0]=4 3003 B13R1.153 C=CCCC(=O)CCc1cccs1 1458a_100000749702_100000748579 [0,0,0,0,1,0|3,0,0]=4 3004 B13R1.153 C=CCCC(=O)CCc1ccsc1 1458a_100000195497_100000754431 [0,0,0,0,1,0|3,0,0]=4 3005 B13R1.153 C=CCCC(=O)CCn1cccc1 1458a_100000749702_200000035178 [0,0,0,0,1,0|3,0,0]=4 3006 B13R1.153 C=CCCC(=O)CCn1cccc1 1458a_100011196273_100000754431 [0,0,0,0,1,0|3,0,0]=4 3007 B13R1.153 C=CCNC(=O)CCc1cc[nH]c1 240690a_100020586998_200000093579 [0,0,0,0,1,0|3,0,0]=4 3008 B13R1.153 C=CCNC(=O)CCc1cc[nH]c1 527a_100020586998_200000093579 [0,0,0,0,1,0|3,0,0]=4 3009 B13R1.153 C=CCNC(=O)CCc1ccc[nH]1 240690a_100020586998_200011998680 [0,0,0,0,1,0|3,0,0]=4 3010 B13R1.153 C=CCNC(=O)CCc1ccc[nH]1 527a_100020586998_200011998680 [0,0,0,0,1,0|3,0,0]=4 3011 B13R1.153 C=CCNC(=O)CCc1ccco1 1626a_100020586998_100000185103 [0,0,0,0,1,0|3,0,0]=4 3012 B13R1.153 C=CCNC(=O)CCc1ccco1 527a_100020586998_100000185103 [0,0,0,0,1,0|3,0,0]=4 3013 B13R1.153 C=CCNC(=O)CCc1cccs1 1626a_100020586998_100000185280 [0,0,0,0,1,0|3,0,0]=4 3014 B13R1.153 C=CCNC(=O)CCc1cccs1 240690a_100020586998_100000185280 [0,0,0,0,1,0|3,0,0]=4 3015 B13R1.153 C=CCNC(=O)CCc1cccs1 527a_100020586998_100000185280 [0,0,0,0,1,0|3,0,0]=4 3016 B13R1.153 C=CCNC(=O)CCc1ccsc1 1626a_100020586998_100000195497 [0,0,0,0,1,0|3,0,0]=4 3017 B13R1.153 C=CCNC(=O)CCc1ccsc1 240690a_100020586998_100000195497 [0,0,0,0,1,0|3,0,0]=4 3018 B13R1.153 C=CCNC(=O)CCc1ccsc1 527a_100020586998_100000195497 [0,0,0,0,1,0|3,0,0]=4 3019 B13R1.153 C=CCNC(=O)CCn1cccc1 1626a_100020586998_100011196273 [0,0,0,0,1,0|3,0,0]=4 3020 B13R1.153 C=CCNC(=O)CCn1cccc1 527a_100020586998_100011196273 [0,0,0,0,1,0|3,0,0]=4 3021 B13R1.153 C=CCNC(=O)COc1ccsc1 7a_100000106738_100000183597 [0,0,0,0,1,0|2,0,0]=3 3022 B13R1.153 C=CCNC(=O)CSc1ccco1 62a_100000183597_100009814098 [0,0,0,0,1,0|2,1,0]=4 3023 B13R1.153 C=CCNC(=O)CSc1ccco1 62a_100009814098_100000183597 [0,0,0,0,1,0|2,1,0]=4 3024 B13R1.153 C=CCNC(=O)CSc1cccs1 62a_100000183597_100011215356 [0,0,0,0,1,0|2,1,0]=4 3025 B13R1.153 C=CCNC(=O)CSc1cccs1 62a_100011215356_100000183597 [0,0,0,0,1,0|2,1,0]=4 3026 B13R1.153 C=CCNC(=O)CSc1ccoc1 62a_100000183597_100011215275 [0,0,0,0,1,0|2,1,0]=4 3027 B13R1.153 C=CCNC(=O)CSc1ccoc1 62a_100011215275_100000183597 [0,0,0,0,1,0|2,1,0]=4 3028 B13R1.153 C=CCNC(=O)CSc1ccsc1 62a_100000183597_100000738268 [0,0,0,0,1,0|2,1,0]=4 3029 B13R1.153 C=CCNC(=O)CSc1ccsc1 62a_100000738268_100000183597 [0,0,0,0,1,0|2,1,0]=4 3030 B13R1.153 C=CCOC(=O)COc1ccsc1 34a_100000106738_100000033060 [0,0,0,0,1,0|1,0,0]=2 3031 B13R1.153 C=CCOC(=O)COc1ccsc1 7a_100000106738_100000033060 [0,0,0,0,1,0|1,0,0]=2 3032 B13R1.153 C=CCOC(=O)CSc1c[nH]cn1 62a_100000033060_100000756875 [0,0,0,0,1,0|2,1,0]=4 3033 B13R1.153 C=CCOC(=O)CSc1c[nH]cn1 62a_100000756875_100000033060 [0,0,0,0,1,0|2,1,0]=4 3034 B13R1.153 C=CCOC(=O)CSc1cc[nH]n1 62a_100000033060_100000062575 [0,0,0,0,1,0|2,1,0]=4 3035 B13R1.153 C=CCOC(=O)CSc1cc[nH]n1 62a_100000062575_100000033060 [0,0,0,0,1,0|2,1,0]=4 3036 B13R1.153 C=CCOC(=O)CSc1ccco1 62a_100000033060_100009814098 [0,0,0,0,1,0|1,1,0]=3 3037 B13R1.153 C=CCOC(=O)CSc1ccco1 62a_100009814098_100000033060 [0,0,0,0,1,0|1,1,0]=3 3038 B13R1.153 C=CCOC(=O)CSc1cccs1 62a_100000033060_100011215356 [0,0,0,0,1,0|1,1,0]=3 3039 B13R1.153 C=CCOC(=O)CSc1cccs1 62a_100011215356_100000033060 [0,0,0,0,1,0|1,1,0]=3 3040 B13R1.153 C=CCOC(=O)CSc1ccoc1 62a_100000033060_100011215275 [0,0,0,0,1,0|1,1,0]=3 3041 B13R1.153 C=CCOC(=O)CSc1ccoc1 62a_100011215275_100000033060 [0,0,0,0,1,0|1,1,0]=3 3042 B13R1.153 C=CCOC(=O)CSc1ccon1 62a_100000033060_100009818083 [0,0,0,0,1,0|2,1,0]=4 3043 B13R1.153 C=CCOC(=O)CSc1ccon1 62a_100009818083_100000033060 [0,0,0,0,1,0|2,1,0]=4 3044 B13R1.153 C=CCOC(=O)CSc1ccsc1 62a_100000033060_100000738268 [0,0,0,0,1,0|1,1,0]=3 3045 B13R1.153 C=CCOC(=O)CSc1ccsc1 62a_100000738268_100000033060 [0,0,0,0,1,0|1,1,0]=3 3046 B13R1.153 C=CCOC(=O)CSc1ccsn1 62a_100000033060_100009818082 [0,0,0,0,1,0|2,1,0]=4 3047 B13R1.153 C=CCOC(=O)CSc1ccsn1 62a_100009818082_100000033060 [0,0,0,0,1,0|2,1,0]=4 3048 B13R1.153 C=CCOC(=O)CSc1cn[nH]c1 62a_100000033060_100000238712 [0,0,0,0,1,0|2,1,0]=4 3049 B13R1.153 C=CCOC(=O)CSc1cn[nH]c1 62a_100000238712_100000033060 [0,0,0,0,1,0|2,1,0]=4 3050 B13R1.153 C=CCOC(=O)CSc1cnco1 62a_100000033060_100020591547 [0,0,0,0,1,0|2,1,0]=4 3051 B13R1.153 C=CCOC(=O)CSc1cnco1 62a_100020591547_100000033060 [0,0,0,0,1,0|2,1,0]=4 3052 B13R1.153 C=CCOC(=O)CSc1cncs1 62a_100000033060_100011934649 [0,0,0,0,1,0|2,1,0]=4 3053 B13R1.153 C=CCOC(=O)CSc1cncs1 62a_100011934649_100000033060 [0,0,0,0,1,0|2,1,0]=4 3054 B13R1.153 C=CCOC(=O)CSc1cnoc1 62a_100000033060_100009815712 [0,0,0,0,1,0|2,1,0]=4 3055 B13R1.153 C=CCOC(=O)CSc1cnoc1 62a_100009815712_100000033060 [0,0,0,0,1,0|2,1,0]=4 3056 B13R1.153 C=CCOC(=O)CSc1cnsc1 62a_100000033060_100009815736 [0,0,0,0,1,0|2,1,0]=4 3057 B13R1.153 C=CCOC(=O)CSc1cnsc1 62a_100009815736_100000033060 [0,0,0,0,1,0|2,1,0]=4 3058 B13R1.153 C=CCOC(=O)CSc1cscn1 62a_100000033060_100000751502 [0,0,0,0,1,0|2,1,0]=4 3059 B13R1.153 C=CCOC(=O)CSc1cscn1 62a_100000751502_100000033060 [0,0,0,0,1,0|2,1,0]=4 3060 B13R1.153 C=CCOC(=O)CSc1ncc[nH]1 62a_100000033060_100025796157 [0,0,0,0,1,0|2,1,0]=4 3061 B13R1.153 C=CCOC(=O)CSc1ncc[nH]1 62a_100025796157_100000033060 [0,0,0,0,1,0|2,1,0]=4 3062 B13R1.153 C=CCOC(=O)CSc1ncco1 62a_100000033060_100011787736 [0,0,0,0,1,0|2,1,0]=4 3063 B13R1.153 C=CCOC(=O)CSc1ncco1 62a_100011787736_100000033060 [0,0,0,0,1,0|2,1,0]=4 3064 B13R1.153 C=CCOC(=O)CSc1nccs1 62a_100000033060_100000211983 [0,0,0,0,1,0|2,1,0]=4 3065 B13R1.153 C=CCOC(=O)CSc1nccs1 62a_100000211983_100000033060 [0,0,0,0,1,0|2,1,0]=4 3066 B13R1.153 CCCOC(=O)COc1ccsc1 34a_100000106738_200011215008 [0,0,0,0,1,0|1,0,2]=4 3067 B13R1.153 CCCOC(=O)COc1ccsc1 7a_100000106738_200011215008 [0,0,0,0,1,0|1,0,2]=4 3068 B15R1.157 C#CCCC(=O)CCOc1ccccc1 1458a_100000182761_100000753159 [0,0,0,0,0,1|1,0,2]=4 3069 B15R1.157 C#CCCC(=O)CCOc1ccccc1 1458a_100000692101_100000184471 [0,0,0,0,0,1|1,0,2]=4 3070 B15R1.157 C#CCCC(=O)COCc1ccccc1 1458a_100000230186_100000753159 [0,0,0,0,0,1|1,0,2]=4 3071 B15R1.157 C#CCNC(=O)CCOc1ccccc1 11a_100000212058_100000182761 [0,0,0,0,0,1|1,0,2]=4 3072 B15R1.157 C#CCNC(=O)CCOc1ccccc1 1626a_100000212058_100000182761 [0,0,0,0,0,1|1,0,2]=4 3073 B15R1.157 C#CCNC(=O)CCOc1ccccc1 240690a_100000212058_100000182761 [0,0,0,0,0,1|1,0,2]=4 3074 B15R1.157 C#CCNC(=O)COCc1ccccc1 11a_100000212058_100000230186 [0,0,0,0,0,1|1,0,2]=4 3075 B15R1.157 C#CCNC(=O)COCc1ccccc1 1626a_100000212058_100000230186 [0,0,0,0,0,1|1,0,2]=4 3076 B15R1.157 C#CCNC(=O)COCc1ccccc1 240690a_100000212058_100000230186 [0,0,0,0,0,1|1,0,2]=4 3077 B15R1.157 C#CCNC(=O)COCc1ccccc1 527a_100000212058_100000230186 [0,0,0,0,0,1|1,0,2]=4 3078 B15R1.157 C/C=C/CC(=O)CCOc1ccccc1 1458a_100000182761_100102629194 [0,0,0,0,0,1|1,0,2]=4 3079 B15R1.157 C/C=C/CC(=O)COCc1ccccc1 1458a_100000230186_100102629194 [0,0,0,0,0,1|1,0,2]=4 3080 B15R1.157 C=C(COCc1ccccc1)OCOC 34a_100000210790_100000042856 [0,0,0,0,0,1|2,0,1]=4 3081 B15R1.157 C=CC=CC(=O)C/C=C/c1ccccc1 1458a_100016291481_100016265936 [0,0,0,0,0,1|2,0,1]=4 3082 B15R1.157 C=CC=CC(=O)CC#Cc1ccccc1 1458a_100016291481_100011352542 [0,0,0,0,0,1|2,0,1]=4 3083 B15R1.157 C=CC=CC(=O)CCCc1ccccc1 1458a_100016291481_100000211621 [0,0,0,0,0,1|2,0,1]=4 3084 B15R1.157 C=CC=CC(=O)CCOc1ccccc1 1458a_100016291481_100000184471 [0,0,0,0,0,1|1,0,1]=3 3085 B15R1.157 C=CC=CC(=O)CCSc1ccccc1 1458a_100016291481_100000246102 [0,0,0,0,0,1|1,1,1]=4 3086 B15R1.157 C=CC=CC(=O)CSCc1ccccc1 1458a_100016291481_200011217039 [0,0,0,0,0,1|1,1,1]=4 3087 B15R1.157 C=CC=CC(=O)NCCc1ccccc1 1626a_100000106460_100016291481 [0,0,0,0,0,1|2,0,1]=4 3088 B15R1.157 C=CCCC(=O)C/C=C/c1ccccc1 1458a_100000749702_100016265936 [0,0,0,0,0,1|2,0,0]=3 3089 B15R1.157 C=CCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000754431 [0,0,0,0,0,1|2,0,0]=3 3090 B15R1.157 C=CCCC(=O)C=CSc1ccccc1 1458a_100016262050_100000754431 [0,0,0,0,0,1|1,1,1]=4 3091 B15R1.157 C=CCCC(=O)CC#Cc1ccccc1 1458a_100000749702_100011352542 [0,0,0,0,0,1|2,0,0]=3 3092 B15R1.157 C=CCCC(=O)CCCc1ccccc1 1458a_100000749702_100000211621 [0,0,0,0,0,1|2,0,0]=3 3093 B15R1.157 C=CCCC(=O)CCCc1ccccc1 1458a_100011207963_100000754431 [0,0,0,0,0,1|2,0,0]=3 3094 B15R1.157 C=CCCC(=O)CCCc1ccccn1 1458a_100000752327_100000754431 [0,0,0,0,0,1|3,0,0]=4 3095 B15R1.157 C=CCCC(=O)CCCc1ccncc1 1458a_100020654287_100000754431 [0,0,0,0,0,1|3,0,0]=4 3096 B15R1.157 C=CCCC(=O)CCOc1ccccc1 1458a_100000182761_100000754431 [0,0,0,0,0,1|1,0,0]=2 3097 B15R1.157 C=CCCC(=O)CCOc1ccccc1 1458a_100000749702_100000184471 [0,0,0,0,0,1|1,0,0]=2 3098 B15R1.157 C=CCCC(=O)CCSc1ccccc1 1458a_100000182436_100000754431 [0,0,0,0,0,1|1,1,0]=3 3099 B15R1.157 C=CCCC(=O)CCSc1ccccc1 1458a_100000749702_100000246102 [0,0,0,0,0,1|1,1,0]=3 3100 B15R1.157 C=CCCC(=O)COCc1ccccc1 1458a_100000230186_100000754431 [0,0,0,0,0,1|1,0,0]=2 3101 B15R1.157 C=CCCC(=O)CSCc1ccccc1 1458a_100000150264_100000754431 [0,0,0,0,0,1|1,1,0]=3 3102 B15R1.157 C=CCCC(=O)CSCc1ccccc1 1458a_100000749702_200011217039 [0,0,0,0,0,1|1,1,0]=3 3103 B15R1.157 C=CCCC(=O)CSCc1ccccn1 1458a_100000742634_100000754431 [0,0,0,0,0,1|2,1,0]=4 3104 B15R1.157 C=CCCC(=O)NCCc1ccccc1 11a_100000106460_100000749702 [0,0,0,0,0,1|2,0,0]=3 3105 B15R1.157 C=CCCC(=O)NCCc1ccccc1 1626a_100000106460_100000749702 [0,0,0,0,0,1|2,0,0]=3 3106 B15R1.157 C=CCCC(=O)NCCc1ccccc1 240690a_100000106460_100000749702 [0,0,0,0,0,1|2,0,0]=3 3107 B15R1.157 C=CCCC(=O)NCCc1ccccc1 527a_100000106460_100000749702 [0,0,0,0,0,1|2,0,0]=3 3108 B15R1.157 C=CCCC(=O)NCCc1ccccn1 11a_100000211156_100000749702 [0,0,0,0,0,1|3,0,0]=4 3109 B15R1.157 C=CCCC(=O)NCCc1ccccn1 1626a_100000211156_100000749702 [0,0,0,0,0,1|3,0,0]=4 3110 B15R1.157 C=CCCC(=O)NCCc1ccccn1 240690a_100000211156_100000749702 [0,0,0,0,0,1|3,0,0]=4 3111 B15R1.157 C=CCCC(=O)NCCc1ccccn1 527a_100000211156_100000749702 [0,0,0,0,0,1|3,0,0]=4 3112 B15R1.157 C=CCCC(=O)NCCc1cccnc1 11a_100000736294_100000749702 [0,0,0,0,0,1|3,0,0]=4 3113 B15R1.157 C=CCCC(=O)NCCc1cccnc1 1626a_100000736294_100000749702 [0,0,0,0,0,1|3,0,0]=4 3114 B15R1.157 C=CCCC(=O)NCCc1cccnc1 240690a_100000736294_100000749702 [0,0,0,0,0,1|3,0,0]=4 3115 B15R1.157 C=CCCC(=O)NCCc1cccnc1 527a_100000736294_100000749702 [0,0,0,0,0,1|3,0,0]=4 3116 B15R1.157 C=CCCC(=O)NCCc1ccncc1 11a_100000742849_100000749702 [0,0,0,0,0,1|3,0,0]=4 3117 B15R1.157 C=CCCC(=O)NCCc1ccncc1 1626a_100000742849_100000749702 [0,0,0,0,0,1|3,0,0]=4 3118 B15R1.157 C=CCCC(=O)NCCc1ccncc1 240690a_100000742849_100000749702 [0,0,0,0,0,1|3,0,0]=4 3119 B15R1.157 C=CCCC(=O)NCCc1ccncc1 527a_100000742849_100000749702 [0,0,0,0,0,1|3,0,0]=4 3120 B15R1.157 C=CCCC(=O)NNCc1ccccc1 22a_100000007032_100000749702 [0,0,0,0,0,1|3,0,0]=4 3121 B15R1.157 C=CCCN(C)CCOc1ccccc1 2230a_100000184383_100000754431 [0,0,0,0,0,1|3,0,0]=4 3122 B15R1.157 C=CCCN(C)CCOc1ccccc1 2230a_100020639649_100000184471 [0,0,0,0,0,1|3,0,0]=4 3123 B15R1.157 C=CCCN(C)CCOc1ccccc1 269982a_100000184383_100000754431 [0,0,0,0,0,1|3,0,0]=4 3124 B15R1.157 C=CCCN(C)CCOc1ccccc1 269982a_100020639649_100000184471 [0,0,0,0,0,1|3,0,0]=4 3125 B15R1.157 C=CCCN(C)CCOc1ccccc1 270004a_100020639649_100000758736 [0,0,0,0,0,1|3,0,0]=4 3126 B15R1.157 C=CCCN(C)COCc1ccccc1 2230a_100020639649_100000763385 [0,0,0,0,0,1|3,0,0]=4 3127 B15R1.157 C=CCNC(=O)C/C=C/c1ccccc1 1626a_100020586998_100011219626 [0,0,0,0,0,1|2,0,0]=3 3128 B15R1.157 C=CCNC(=O)C/C=C/c1ccccc1 240690a_100020586998_100011219626 [0,0,0,0,0,1|2,0,0]=3 3129 B15R1.157 C=CCNC(=O)C=CSc1ccccc1 1626a_100020586998_100016262050 [0,0,0,0,0,1|1,1,1]=4 3130 B15R1.157 C=CCNC(=O)C=CSc1ccccc1 240690a_100020586998_100016262050 [0,0,0,0,0,1|1,1,1]=4 3131 B15R1.157 C=CCNC(=O)CCCc1ccccc1 1626a_100020586998_100011207963 [0,0,0,0,0,1|2,0,0]=3 3132 B15R1.157 C=CCNC(=O)CCCc1ccccc1 240690a_100020586998_100011207963 [0,0,0,0,0,1|2,0,0]=3 3133 B15R1.157 C=CCNC(=O)CCCc1ccccc1 527a_100020586998_100011207963 [0,0,0,0,0,1|2,0,0]=3 3134 B15R1.157 C=CCNC(=O)CCCc1ccccn1 1626a_100020586998_100000752327 [0,0,0,0,0,1|3,0,0]=4 3135 B15R1.157 C=CCNC(=O)CCCc1ccccn1 240690a_100020586998_100000752327 [0,0,0,0,0,1|3,0,0]=4 3136 B15R1.157 C=CCNC(=O)CCCc1ccccn1 527a_100020586998_100000752327 [0,0,0,0,0,1|3,0,0]=4 3137 B15R1.157 C=CCNC(=O)CCCc1ccncc1 1626a_100020586998_100020654287 [0,0,0,0,0,1|3,0,0]=4 3138 B15R1.157 C=CCNC(=O)CCCc1ccncc1 240690a_100020586998_100020654287 [0,0,0,0,0,1|3,0,0]=4 3139 B15R1.157 C=CCNC(=O)CCCc1ccncc1 527a_100020586998_100020654287 [0,0,0,0,0,1|3,0,0]=4 3140 B15R1.157 C=CCNC(=O)CCOc1ccccc1 1626a_100020586998_100000182761 [0,0,0,0,0,1|1,0,0]=2 3141 B15R1.157 C=CCNC(=O)CCOc1ccccc1 240690a_100020586998_100000182761 [0,0,0,0,0,1|1,0,0]=2 3142 B15R1.157 C=CCNC(=O)CCOc1ccccc1 7a_100000210340_100011222895 [0,0,0,0,0,1|1,0,0]=2 3143 B15R1.157 C=CCNC(=O)CCOc1cccnc1 7a_100000210849_100011222895 [0,0,0,0,0,1|2,0,0]=3 3144 B15R1.157 C=CCNC(=O)CCOc1cncnc1 7a_100000754086_100011222895 [0,0,0,0,0,1|3,0,0]=4 3145 B15R1.157 C=CCNC(=O)CCSc1ccccc1 1626a_100020586998_100000182436 [0,0,0,0,0,1|1,1,0]=3 3146 B15R1.157 C=CCNC(=O)CCSc1ccccc1 240690a_100020586998_100000182436 [0,0,0,0,0,1|1,1,0]=3 3147 B15R1.157 C=CCNC(=O)CCSc1ccccc1 62a_100000719477_100011222895 [0,0,0,0,0,1|1,1,0]=3 3148 B15R1.157 C=CCNC(=O)CCSc1ccccc1 62a_100011222895_100000041952 [0,0,0,0,0,1|1,1,0]=3 3149 B15R1.157 C=CCNC(=O)CCSc1ccccn1 62a_100011216584_100011222895 [0,0,0,0,0,1|2,1,0]=4 3150 B15R1.157 C=CCNC(=O)CCSc1ccccn1 62a_100011222895_100011216584 [0,0,0,0,0,1|2,1,0]=4 3151 B15R1.157 C=CCNC(=O)CCSc1cccnc1 62a_100000210063_100011222895 [0,0,0,0,0,1|2,1,0]=4 3152 B15R1.157 C=CCNC(=O)CCSc1cccnc1 62a_100011222895_100000210063 [0,0,0,0,0,1|2,1,0]=4 3153 B15R1.157 C=CCNC(=O)CCSc1ccncc1 62a_100000728582_100011222895 [0,0,0,0,0,1|2,1,0]=4 3154 B15R1.157 C=CCNC(=O)CCSc1ccncc1 62a_100011222895_100000728582 [0,0,0,0,0,1|2,1,0]=4 3155 B15R1.157 C=CCNC(=O)CNCc1ccccc1 2230a_100015324214_100000183597 [0,0,0,0,0,1|2,0,0]=3 3156 B15R1.157 C=CCNC(=O)COCc1ccccc1 1626a_100020586998_100000230186 [0,0,0,0,0,1|1,0,0]=2 3157 B15R1.157 C=CCNC(=O)COCc1ccccc1 240690a_100020586998_100000230186 [0,0,0,0,0,1|1,0,0]=2 3158 B15R1.157 C=CCNC(=O)COCc1ccccc1 527a_100020586998_100000230186 [0,0,0,0,0,1|1,0,0]=2 3159 B15R1.157 C=CCNC(=O)COCc1ccccc1 7a_100000210790_100000183597 [0,0,0,0,0,1|1,0,0]=2 3160 B15R1.157 C=CCNC(=O)CSCc1ccccc1 1626a_100020586998_100000150264 [0,0,0,0,0,1|1,1,0]=3 3161 B15R1.157 C=CCNC(=O)CSCc1ccccc1 240690a_100020586998_100000150264 [0,0,0,0,0,1|1,1,0]=3 3162 B15R1.157 C=CCNC(=O)CSCc1ccccc1 527a_100020586998_100000150264 [0,0,0,0,0,1|1,1,0]=3 3163 B15R1.157 C=CCNC(=O)CSCc1ccccc1 62a_100000183597_100015291786 [0,0,0,0,0,1|1,1,0]=3 3164 B15R1.157 C=CCNC(=O)CSCc1ccccc1 62a_100000211182_100000183597 [0,0,0,0,0,1|1,1,0]=3 3165 B15R1.157 C=CCNC(=O)CSCc1ccccn1 1626a_100020586998_100000742634 [0,0,0,0,0,1|2,1,0]=4 3166 B15R1.157 C=CCNC(=O)CSCc1ccccn1 240690a_100020586998_100000742634 [0,0,0,0,0,1|2,1,0]=4 3167 B15R1.157 C=CCNC(=O)CSCc1ccccn1 527a_100020586998_100000742634 [0,0,0,0,0,1|2,1,0]=4 3168 B15R1.157 C=CCNC(=O)CSCc1ccccn1 62a_100000183597_100000721315 [0,0,0,0,0,1|2,1,0]=4 3169 B15R1.157 C=CCNC(=O)CSCc1ccccn1 62a_100000721315_100000183597 [0,0,0,0,0,1|2,1,0]=4 3170 B15R1.157 C=CCNC(=O)CSCc1cccnc1 62a_100000183597_100000741622 [0,0,0,0,0,1|2,1,0]=4 3171 B15R1.157 C=CCNC(=O)CSCc1cccnc1 62a_100000741622_100000183597 [0,0,0,0,0,1|2,1,0]=4 3172 B15R1.157 C=CCNC(=O)CSCc1ccncc1 1626a_100020586998_100000742635 [0,0,0,0,0,1|2,1,0]=4 3173 B15R1.157 C=CCNC(=O)CSCc1ccncc1 240690a_100020586998_100000742635 [0,0,0,0,0,1|2,1,0]=4 3174 B15R1.157 C=CCNC(=O)CSCc1ccncc1 527a_100020586998_100000742635 [0,0,0,0,0,1|2,1,0]=4 3175 B15R1.157 C=CCNC(=O)CSCc1ccncc1 62a_100000183597_100015193705 [0,0,0,0,0,1|2,1,0]=4 3176 B15R1.157 C=CCNC(=O)CSCc1ccncc1 62a_100015193705_100000183597 [0,0,0,0,0,1|2,1,0]=4 3177 B15R1.157 C=CCNC(=O)NCCc1ccccc1 2708a_100000106460_100020586998 [0,0,0,0,0,1|2,0,0]=3 3178 B15R1.157 C=CCNC(=O)NCCc1ccccc1 273464a_100000106460_100020586998 [0,0,0,0,0,1|2,0,0]=3 3179 B15R1.157 C=CCNC(=O)NCCc1ccccc1 273464a_100020586998_100000106460 [0,0,0,0,0,1|2,0,0]=3 3180 B15R1.157 C=CCNC(=O)NCCc1ccccc1 512a_100000106460_100020586998 [0,0,0,0,0,1|2,0,0]=3 3181 B15R1.157 C=CCNC(=O)NCCc1ccccc1 512a_100020586998_100000106460 [0,0,0,0,0,1|2,0,0]=3 3182 B15R1.157 C=CCNC(=O)NCCc1ccccn1 2708a_100000211156_100020586998 [0,0,0,0,0,1|3,0,0]=4 3183 B15R1.157 C=CCNC(=O)NCCc1ccccn1 273464a_100000211156_100020586998 [0,0,0,0,0,1|3,0,0]=4 3184 B15R1.157 C=CCNC(=O)NCCc1ccccn1 273464a_100020586998_100000211156 [0,0,0,0,0,1|3,0,0]=4 3185 B15R1.157 C=CCNC(=O)NCCc1ccccn1 512a_100020586998_100000211156 [0,0,0,0,0,1|3,0,0]=4 3186 B15R1.157 C=CCNC(=O)NCCc1cccnc1 2708a_100000736294_100020586998 [0,0,0,0,0,1|3,0,0]=4 3187 B15R1.157 C=CCNC(=O)NCCc1cccnc1 273464a_100000736294_100020586998 [0,0,0,0,0,1|3,0,0]=4 3188 B15R1.157 C=CCNC(=O)NCCc1cccnc1 273464a_100020586998_100000736294 [0,0,0,0,0,1|3,0,0]=4 3189 B15R1.157 C=CCNC(=O)NCCc1cccnc1 512a_100000736294_100020586998 [0,0,0,0,0,1|3,0,0]=4 3190 B15R1.157 C=CCNC(=O)NCCc1cccnc1 512a_100020586998_100000736294 [0,0,0,0,0,1|3,0,0]=4 3191 B15R1.157 C=CCNC(=O)NCCc1ccncc1 2708a_100000742849_100020586998 [0,0,0,0,0,1|3,0,0]=4 3192 B15R1.157 C=CCNC(=O)NCCc1ccncc1 273464a_100000742849_100020586998 [0,0,0,0,0,1|3,0,0]=4 3193 B15R1.157 C=CCNC(=O)NCCc1ccncc1 273464a_100020586998_100000742849 [0,0,0,0,0,1|3,0,0]=4 3194 B15R1.157 C=CCNC(=O)NCCc1ccncc1 512a_100020586998_100000742849 [0,0,0,0,0,1|3,0,0]=4 3195 B15R1.157 C=CCNC(=O)NNCc1ccccc1 273464a_100020586998_100000007032 [0,0,0,0,0,1|3,0,0]=4 3196 B15R1.157 C=CCNC(=O)NNCc1ccccc1 512a_100020586998_100000007032 [0,0,0,0,0,1|3,0,0]=4 3197 B15R1.157 C=CCNC(C)COCc1ccccc1 270004a_100020586998_100011215004 [0,0,0,0,0,1|2,0,1]=4 3198 B15R1.157 C=CCOC(=O)CNCc1ccccc1 2230a_100015324214_100000033060 [0,0,0,0,0,1|1,0,0]=2 3199 B15R1.157 C=CCOC(=O)CNCc1ccccc1 34a_100015324214_100000033060 [0,0,0,0,0,1|1,0,0]=2 3200 B15R1.157 C=CCOC(=O)CNCc1cccnn1 2230a_100159270163_100000033060 [0,0,0,0,0,1|3,0,0]=4 3201 B15R1.157 C=CCOC(=O)CNCc1cncnc1 2230a_100011243677_100000033060 [0,0,0,0,0,1|3,0,0]=4 3202 B15R1.157 C=CCOC(=O)COCc1ccccc1 34a_100000210790_100000033060 [0,0,0,0,0,1|0,0,0]=1 3203 B15R1.157 C=CCOC(=O)COCc1ccccc1 7a_100000210790_100000033060 [0,0,0,0,0,1|0,0,0]=1 3204 B15R1.157 C=CCOC(=O)CSCc1ccccc1 62a_100000033060_100015291786 [0,0,0,0,0,1|0,1,0]=2 3205 B15R1.157 C=CCOC(=O)CSCc1ccccc1 62a_100000211182_100000033060 [0,0,0,0,0,1|0,1,0]=2 3206 B15R1.157 C=CCOC(=O)CSCc1ccccn1 62a_100000033060_100000721315 [0,0,0,0,0,1|1,1,0]=3 3207 B15R1.157 C=CCOC(=O)CSCc1ccccn1 62a_100000721315_100000033060 [0,0,0,0,0,1|1,1,0]=3 3208 B15R1.157 C=CCOC(=O)CSCc1cccnc1 62a_100000033060_100000741622 [0,0,0,0,0,1|1,1,0]=3 3209 B15R1.157 C=CCOC(=O)CSCc1cccnc1 62a_100000741622_100000033060 [0,0,0,0,0,1|1,1,0]=3 3210 B15R1.157 C=CCOC(=O)CSCc1cccnn1 62a_100000033060_100016990269 [0,0,0,0,0,1|2,1,0]=4 3211 B15R1.157 C=CCOC(=O)CSCc1cccnn1 62a_100016990269_100000033060 [0,0,0,0,0,1|2,1,0]=4 3212 B15R1.157 C=CCOC(=O)CSCc1ccncc1 62a_100000033060_100015193705 [0,0,0,0,0,1|1,1,0]=3 3213 B15R1.157 C=CCOC(=O)CSCc1ccncc1 62a_100015193705_100000033060 [0,0,0,0,0,1|1,1,0]=3 3214 B15R1.157 C=CCOC(=O)CSCc1cnccn1 62a_100000033060_100016995436 [0,0,0,0,0,1|2,1,0]=4 3215 B15R1.157 C=CCOC(=O)CSCc1cnccn1 62a_100016995436_100000033060 [0,0,0,0,0,1|2,1,0]=4 3216 B15R1.157 C=CCOC(=O)CSCc1cncnc1 62a_100000033060_100015196519 [0,0,0,0,0,1|2,1,0]=4 3217 B15R1.157 C=CCOC(=O)CSCc1cncnc1 62a_100015196519_100000033060 [0,0,0,0,0,1|2,1,0]=4 3218 B15R1.157 C=CCOC(=O)CSCc1ncccn1 62a_100000033060_100000703007 [0,0,0,0,0,1|2,1,0]=4 3219 B15R1.157 C=CCOC(=O)CSCc1ncccn1 62a_100000703007_100000033060 [0,0,0,0,0,1|2,1,0]=4 3220 B15R1.157 C=CCOC(C)CCCc1ccccc1 34a_200000210373_200010759516 [0,0,0,0,0,1|2,0,1]=4 3221 B15R1.157 C=CCOC(C)COCc1ccccc1 34a_100000764311_100015514636 [0,0,0,0,0,1|1,0,1]=3 3222 B15R1.157 C=CCOC(C)COCc1ccccc1 7a_100000764311_100015514636 [0,0,0,0,0,1|1,0,1]=3 3223 B15R1.157 CC(COCc1ccccc1)OCC=O 34a_100000764311_200009817547 [0,0,0,0,0,1|2,0,1]=4 3224 B15R1.157 CC(COCc1ccccc1)OCC=O 7a_100000764311_200015260668 [0,0,0,0,0,1|2,0,1]=4 3225 B15R1.157 CC=CCC(=O)CCOc1ccccc1 1458a_100000182761_100000070051 [0,0,0,0,0,1|1,0,2]=4 3226 B15R1.157 CC=CCC(=O)CCOc1ccccc1 1458a_100121576822_100000184471 [0,0,0,0,0,1|1,0,2]=4 3227 B15R1.157 CC=CCC(=O)COCc1ccccc1 1458a_100000230186_100000070051 [0,0,0,0,0,1|1,0,2]=4 3228 B15R1.157 CCCCC(=O)CCOc1ccccc1 1458a_100000182761_100000210211 [0,0,0,0,0,1|1,0,2]=4 3229 B15R1.157 CCCCC(=O)CCOc1ccccc1 1458a_100000210183_100000184471 [0,0,0,0,0,1|1,0,2]=4 3230 B15R1.157 CCCCC(=O)COCc1ccccc1 1458a_100000230186_100000210211 [0,0,0,0,0,1|1,0,2]=4 3231 B15R1.157 CCCNC(=O)CCOc1ccccc1 11a_100020643023_100000182761 [0,0,0,0,0,1|1,0,2]=4 3232 B15R1.157 CCCNC(=O)CCOc1ccccc1 1626a_100020643023_100000182761 [0,0,0,0,0,1|1,0,2]=4 3233 B15R1.157 CCCNC(=O)CCOc1ccccc1 240690a_100020643023_100000182761 [0,0,0,0,0,1|1,0,2]=4 3234 B15R1.157 CCCNC(=O)COCc1ccccc1 11a_100020643023_100000230186 [0,0,0,0,0,1|1,0,2]=4 3235 B15R1.157 CCCNC(=O)COCc1ccccc1 1626a_100020643023_100000230186 [0,0,0,0,0,1|1,0,2]=4 3236 B15R1.157 CCCNC(=O)COCc1ccccc1 240690a_100020643023_100000230186 [0,0,0,0,0,1|1,0,2]=4 3237 B15R1.157 CCCNC(=O)COCc1ccccc1 34a_100000210790_100000183358 [0,0,0,0,0,1|1,0,2]=4 3238 B15R1.157 CCCNC(=O)COCc1ccccc1 527a_100020643023_100000230186 [0,0,0,0,0,1|1,0,2]=4 3239 B15R1.157 CCCNC(=O)COCc1ccccc1 7a_100000210790_100000183358 [0,0,0,0,0,1|1,0,2]=4 3240 B15R1.157 CCCOC(=O)CNCc1ccccc1 2230a_100015324214_200011215008 [0,0,0,0,0,1|1,0,2]=4 3241 B15R1.157 CCCOC(=O)CNCc1ccccc1 34a_100015324214_200011215008 [0,0,0,0,0,1|1,0,2]=4 3242 B15R1.157 CCCOC(=O)COCc1ccccc1 34a_100000210790_200011215008 [0,0,0,0,0,1|0,0,2]=3 3243 B15R1.157 CCCOC(=O)COCc1ccccc1 7a_100000210790_200011215008 [0,0,0,0,0,1|0,0,2]=3 3244 B15R1.157 CCCOC(=O)CSCc1ccccc1 62a_100000211182_200011215008 [0,0,0,0,0,1|0,1,2]=4 3245 B15R1.157 CCCOC(=O)CSCc1ccccc1 62a_200011215008_100015291786 [0,0,0,0,0,1|0,1,2]=4 3246 B15R1.157 CCCOC(=O)OCNc1ccccc1 34a_100000106764_200000139673 [0,0,0,0,0,1|1,0,2]=4 3247 B15R1.157 CCCOC(=O)OCOc1ccccc1 34a_100000210340_200000139673 [0,0,0,0,0,1|0,0,2]=3 3248 B15R1.157 CCCOC(=O)OCOc1ccccc1 7a_100000210340_200000139673 [0,0,0,0,0,1|0,0,2]=3 3249 B15R1.157 CCCOC(=O)OCOc1cccnc1 34a_100000210849_200000139673 [0,0,0,0,0,1|1,0,2]=4 3250 B15R1.157 CCCOC(=O)OCOc1cccnc1 7a_100000210849_200000139673 [0,0,0,0,0,1|1,0,2]=4 3251 B15R1.157 CCCOC(=O)OCOc1ccncc1 34a_100000212176_200000139673 [0,0,0,0,0,1|1,0,2]=4 3252 B15R1.157 CCCOC(=O)OCSc1ccccc1 62a_100000719477_200000139673 [0,0,0,0,0,1|0,1,2]=4 3253 B15R1.157 COCCC(=O)CCOc1ccccc1 1458a_100000182761_100000233755 [0,0,0,0,0,1|2,0,1]=4 3254 B15R1.157 COCCC(=O)CCOc1ccccc1 1458a_100000749529_100000184471 [0,0,0,0,0,1|2,0,1]=4 3255 B15R1.157 COCCC(=O)COCc1ccccc1 1458a_100000230186_100000233755 [0,0,0,0,0,1|2,0,1]=4 3256 B15R1.157 CSCCC(=O)CCOc1ccccc1 1458a_100000174002_100000184471 [0,0,0,0,0,1|2,0,1]=4 3257 B15R1.157 CSCCC(=O)CCOc1ccccc1 1458a_100000182761_100000751147 [0,0,0,0,0,1|2,0,1]=4 3258 B15R1.157 CSCCC(=O)COCc1ccccc1 1458a_100000230186_100000751147 [0,0,0,0,0,1|2,0,1]=4 3259 B15R1.157 N#CCCC(=O)CCOc1ccccc1 1458a_100000182761_100011215226 [0,0,0,0,0,1|2,0,1]=4 3260 B15R1.157 N#CCCC(=O)CCOc1ccccc1 1458a_100011934036_100000184471 [0,0,0,0,0,1|2,0,1]=4 3261 B15R1.157 N#CCCC(=O)COCc1ccccc1 1458a_100000230186_100011215226 [0,0,0,0,0,1|2,0,1]=4 3262 B15R1.157 N#CCNC(=O)CCOc1ccccc1 1626a_100000734998_100000182761 [0,0,0,0,0,1|2,0,1]=4 3263 B15R1.157 N#CCNC(=O)COCc1ccccc1 1626a_100000734998_100000230186 [0,0,0,0,0,1|2,0,1]=4 3264 B15R1.157 N#CCNC(=O)COCc1ccccc1 527a_100000734998_100000230186 [0,0,0,0,0,1|2,0,1]=4 3265 B15R1.157 N#CCNC(=O)COCc1ccccc1 7a_100000210790_100000736037 [0,0,0,0,0,1|2,0,1]=4 3266 B15R1.157 O=C(CCCF)CCOc1ccccc1 1458a_100000182761_100011934791 [0,0,0,0,0,1|2,0,1]=4 3267 B15R1.157 O=C(CCCF)COCc1ccccc1 1458a_100000230186_100011934791 [0,0,0,0,0,1|2,0,1]=4 3268 B15R1.157 O=C(CCCO)CCOc1ccccc1 1458a_100000182761_100011215043 [0,0,0,0,0,1|2,0,1]=4 3269 B15R1.157 O=C(CCCO)COCc1ccccc1 1458a_100000230186_100011215043 [0,0,0,0,0,1|2,0,1]=4 3270 B15R1.157 O=C(CCOc1ccccc1)NCCF 11a_100000724931_100000182761 [0,0,0,0,0,1|2,0,1]=4 3271 B15R1.157 O=C(CCOc1ccccc1)NCCF 1626a_100000724931_100000182761 [0,0,0,0,0,1|2,0,1]=4 3272 B15R1.157 O=C(CCOc1ccccc1)NCCF 240690a_100000724931_100000182761 [0,0,0,0,0,1|2,0,1]=4 3273 B15R1.157 O=C(CCOc1ccccc1)NCCO 240690a_100000210304_100000182761 [0,0,0,0,0,1|2,0,1]=4 3274 B15R1.157 O=C(COCc1ccccc1)NCCF 11a_100000724931_100000230186 [0,0,0,0,0,1|2,0,1]=4 3275 B15R1.157 O=C(COCc1ccccc1)NCCF 1626a_100000724931_100000230186 [0,0,0,0,0,1|2,0,1]=4 3276 B15R1.157 O=C(COCc1ccccc1)NCCF 240690a_100000724931_100000230186 [0,0,0,0,0,1|2,0,1]=4 3277 B15R1.157 O=C(COCc1ccccc1)NCCF 527a_100000724931_100000230186 [0,0,0,0,0,1|2,0,1]=4 3278 B15R1.157 O=C(COCc1ccccc1)NCCO 240690a_100000210304_100000230186 [0,0,0,0,0,1|2,0,1]=4 3279 B15R1.157 O=C(COCc1ccccc1)NCCO 527a_100000210304_100000230186 [0,0,0,0,0,1|2,0,1]=4 3280 B12R0.1 C=COC(=O)COC/C=C/C=C/C 34a_100016283227_100000036128 [1,0,1,0,0,0|0,0,2]=4 3281 B12R0.74 C=CCC(C=C)OCC(=O)OC=C 34a_100000038011_100000036128 [1,0,1,0,0,0|0,0,2]=4 3282 B12R0.133 C=CCOC(=O)COC(C=C)C=C 34a_100000033096_100000033060 [1,0,1,0,0,0|0,0,1]=3 3283 B12R1.8 C=CCCCNc1ccccc1 34a_100000106764_100000757094 [2,0,0,0,0,0|1,0,1]=4 3284 B12R1.8 C=CCCCOc1ccccc1 34a_100000210340_100000757094 [2,0,0,0,0,0|0,0,1]=3 3285 B12R1.8 C=CCCCOc1ccccc1 7a_100000210340_100000757094 [2,0,0,0,0,0|0,0,1]=3 3286 B12R1.8 C=CCCCOc1cccnc1 34a_100000210849_100000757094 [2,0,0,0,0,0|1,0,1]=4 3287 B12R1.8 C=CCCCOc1cccnc1 7a_100000210849_100000757094 [2,0,0,0,0,0|1,0,1]=4 3288 B12R1.8 C=CCCCOc1ccncc1 34a_100000212176_100000757094 [2,0,0,0,0,0|1,0,1]=4 3289 B12R1.8 C=CCCCSc1ccccc1 62a_100000719477_100000757094 [2,0,0,0,0,0|0,1,1]=4 3290 B12R1.8 C=CCCCSc1ccccc1 62a_100011713584_100000041952 [2,0,0,0,0,0|0,1,1]=4 3291 B12R1.8 C=CCCNCc1ccccc1 207a_100015191253_100015611070 [2,0,0,0,0,0|2,0,0]=4 3292 B12R1.8 C=CCCNCc1ccccc1 2230a_100015191253_100015291786 [2,0,0,0,0,0|2,0,0]=4 3293 B12R1.8 C=CCCNCc1ccccc1 2230a_100015324214_100000754431 [2,0,0,0,0,0|2,0,0]=4 3294 B12R1.8 C=CCCNCc1ccccc1 270004a_100015191253_100015611070 [2,0,0,0,0,0|2,0,0]=4 3295 B12R1.8 C=CCCNCc1ccccc1 34a_100015324214_100000754431 [2,0,0,0,0,0|2,0,0]=4 3296 B12R1.8 C=CCCOCc1ccccc1 34a_100000210790_100000754431 [2,0,0,0,0,0|2,0,0]=4 3297 B12R1.8 C=CCCOCc1ccccc1 34a_100011205117_100015291786 [2,0,0,0,0,0|2,0,0]=4 3298 B12R1.8 C=CCCOCc1ccccc1 7a_100000210790_100000754431 [2,0,0,0,0,0|2,0,0]=4 3299 B12R1.8 C=CCCSCc1ccccc1 62a_100000211182_100000754431 [2,0,0,0,0,0|2,0,0]=4 3300 B12R1.8 C=CCCSCc1ccccc1 62a_100000754431_100015291786 [2,0,0,0,0,0|2,0,0]=4 3301 B12R1.8 C=CCNCCc1ccccc1 2230a_100000106460_100000210623 [2,0,0,0,0,0|1,0,1]=4 3302 B12R1.8 C=CCNCCc1ccccc1 2230a_100020586998_100000765856 [2,0,0,0,0,0|1,0,1]=4 3303 B12R1.8 C=CCNCCc1ccccc1 34a_100000106460_100015514636 [2,0,0,0,0,0|1,0,1]=4 3304 B12R1.8 C=CCNCSc1ccccc1 2230a_100020586998_100011218342 [2,0,0,0,0,0|1,1,0]=4 3305 B12R1.8 C=CCOCCc1ccccc1 34a_100000210268_100015514636 [2,0,0,0,0,0|0,0,1]=3 3306 B12R1.8 C=CCOCCc1ccccc1 34a_200000210373_100000765856 [2,0,0,0,0,0|0,0,1]=3 3307 B12R1.8 C=CCOCCc1ccccc1 7a_100000210268_100015514636 [2,0,0,0,0,0|0,0,1]=3 3308 B12R1.8 C=CCOCCc1ccccn1 34a_100000210271_100015514636 [2,0,0,0,0,0|1,0,1]=4 3309 B12R1.8 C=CCOCCc1cccnc1 34a_100011217484_100015514636 [2,0,0,0,0,0|1,0,1]=4 3310 B12R1.8 C=CCOCCc1ccncc1 34a_100011216225_100015514636 [2,0,0,0,0,0|1,0,1]=4 3311 B12R1.8 C=CCSCCc1ccccc1 62a_100000210623_100011218657 [2,0,0,0,0,0|0,1,1]=4 3312 B12R1.8 C=CCSCCc1ccccc1 62a_100000765856_100000210623 [2,0,0,0,0,0|0,1,1]=4 3313 B12R1.8 C=CCSCSc1ccccc1 62a_100000210623_100011218342 [2,0,0,0,0,0|0,2,0]=4 3314 B12R1.8 C=CCSCSc1ccccc1 62a_100011218342_100000210623 [2,0,0,0,0,0|0,2,0]=4 3315 B12R1.8 C=COCCNc1ccccc1 34a_100000106764_100000039644 [2,0,0,0,0,0|1,0,1]=4 3316 B12R1.8 C=COCCOc1ccccc1 34a_100000210340_100000039644 [2,0,0,0,0,0|0,0,1]=3 3317 B12R1.8 C=COCCOc1ccccc1 7a_100000210340_100000039644 [2,0,0,0,0,0|0,0,1]=3 3318 B12R1.8 C=COCCOc1cccnc1 34a_100000210849_100000039644 [2,0,0,0,0,0|1,0,1]=4 3319 B12R1.8 C=COCCOc1cccnc1 7a_100000210849_100000039644 [2,0,0,0,0,0|1,0,1]=4 3320 B12R1.8 C=COCCOc1ccncc1 34a_100000212176_100000039644 [2,0,0,0,0,0|1,0,1]=4 3321 B12R1.8 C=COCCSc1ccccc1 62a_100000039644_100000041952 [2,0,0,0,0,0|0,1,1]=4 3322 B12R1.8 C=COCCSc1ccccc1 62a_100000719477_100000039644 [2,0,0,0,0,0|0,1,1]=4 3323 B12R1.8 CC/C=C\COc1ccccc1 34a_100000210340_100103147603 [2,0,0,0,0,0|1,0,1]=4 3324 B12R1.8 CC/C=C\COc1ccccc1 7a_100000210340_100103147603 [2,0,0,0,0,0|1,0,1]=4 3325 B12R1.8 CCOCCOc1ccccc1 34a_100000210260_100000210202 [2,0,0,0,0,0|0,0,2]=4 3326 B12R1.8 CCOCCOc1ccccc1 34a_100000210340_100000210147 [2,0,0,0,0,0|0,0,2]=4 3327 B12R1.8 CCOCCOc1ccccc1 34a_100121572206_100000184471 [2,0,0,0,0,0|0,0,2]=4 3328 B12R1.8 CCOCCOc1ccccc1 7a_100000210260_100000210202 [2,0,0,0,0,0|0,0,2]=4 3329 B12R1.8 CCOCCOc1ccccc1 7a_100000210340_100011215890 [2,0,0,0,0,0|0,0,2]=4 3330 B12R1.8 FCOCCOc1ccccc1 34a_100000210260_100015361967 [2,0,0,0,0,0|1,0,1]=4 3331 B12R1.8 FCOCCOc1ccccc1 7a_100000210260_100015361967 [2,0,0,0,0,0|1,0,1]=4 3332 B12R1.8 O=CCCCOc1ccccc1 7a_100000210340_200011292268 [2,0,0,0,0,0|1,0,1]=4 3333 B12R1.8 O=CCOCCc1ccccc1 34a_100000210268_200009817547 [2,0,0,0,0,0|1,0,1]=4 3334 B12R1.8 O=CCOCCc1ccccc1 7a_100000210268_200015260668 [2,0,0,0,0,0|1,0,1]=4 3335 B12R1.27 C=CC(=O)CCc1ccccc1 1458a_100000185746_100000765856 [2,0,0,0,0,0|1,0,0]=3 3336 B12R1.27 C=CC(=O)CCc1ccccn1 1458a_100000185746_100015183660 [2,0,0,0,0,0|2,0,0]=4 3337 B12R1.27 C=CC(=O)CCc1cccnc1 1458a_100000185746_200011713674 [2,0,0,0,0,0|2,0,0]=4 3338 B12R1.27 C=CC(=O)CCc1ccncc1 1458a_100000185746_100000723409 [2,0,0,0,0,0|2,0,0]=4 3339 B12R1.27 C=CC(=O)NCc1ccccc1 1626a_100015324214_100000185746 [2,0,0,0,0,0|2,0,0]=4 3340 B12R1.27 C=CC(=O)NCc1ccccc1 240690a_100015324214_200121576911 [2,0,0,0,0,0|2,0,0]=4 3341 B12R1.27 C=CC(=O)NNc1ccccc1 22a_100015195140_100000185746 [2,0,0,0,0,0|2,0,0]=4 3342 B12R1.27 C=CC(O)COc1ccccc1 34a_100000210340_100000730141 [2,0,0,0,0,0|0,0,2]=4 3343 B12R1.27 C=CC(O)COc1ccccc1 7a_100000210340_100000730141 [2,0,0,0,0,0|0,0,2]=4 3344 B12R1.27 CC(COc1ccccc1)O[13CH3] 34a_100000210911_200025704644 [2,0,0,0,0,0|1,0,1]=4 3345 B12R1.27 CC(COc1ccccc1)O[13CH3] 7a_100000210911_200025704644 [2,0,0,0,0,0|1,0,1]=4 3346 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000185753_100000210202 [2,0,0,0,0,0|1,0,1]=4 3347 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000210414_100000765856 [2,0,0,0,0,0|1,0,1]=4 3348 B12R1.27 CCC(=O)COc1ccccc1 1458a_100000186222_100000210202 [2,0,0,0,0,0|0,0,1]=3 3349 B12R1.27 CCC(=O)COc1ccccc1 7a_100000210340_100000747405 [2,0,0,0,0,0|0,0,1]=3 3350 B12R1.27 CCC(=O)COc1ccccn1 1458a_100102699861_100000210202 [2,0,0,0,0,0|1,0,1]=4 3351 B12R1.27 CCC(=O)COc1cccnc1 1458a_100015207166_100000210202 [2,0,0,0,0,0|1,0,1]=4 3352 B12R1.27 CCC(=O)COc1cccnc1 7a_100000210849_100000747405 [2,0,0,0,0,0|1,0,1]=4 3353 B12R1.27 CCC(=O)CSc1ccccc1 1458a_100000211596_100000210202 [2,0,0,0,0,0|0,1,1]=4 3354 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000719477_100000747405 [2,0,0,0,0,0|0,1,1]=4 3355 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000747405_100000041952 [2,0,0,0,0,0|0,1,1]=4 3356 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [2,0,0,0,0,0|2,0,0]=4 3357 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [2,0,0,0,0,0|2,0,0]=4 3358 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [2,0,0,0,0,0|2,0,0]=4 3359 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [2,0,0,0,0,0|2,0,0]=4 3360 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [2,0,0,0,0,0|2,0,0]=4 3361 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [2,0,0,0,0,0|1,0,0]=3 3362 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [2,0,0,0,0,0|1,0,0]=3 3363 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [2,0,0,0,0,0|1,0,0]=3 3364 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [2,0,0,0,0,0|1,0,0]=3 3365 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [2,0,0,0,0,0|1,0,0]=3 3366 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [2,0,0,0,0,0|1,0,0]=3 3367 B12R1.27 CNC(=O)COc1ccccn1 1626a_100102657272_100102699861 [2,0,0,0,0,0|2,0,0]=4 3368 B12R1.27 CNC(=O)COc1ccccn1 240690a_100102657272_100102699861 [2,0,0,0,0,0|2,0,0]=4 3369 B12R1.27 CNC(=O)COc1ccccn1 527a_100102657272_100102699861 [2,0,0,0,0,0|2,0,0]=4 3370 B12R1.27 CNC(=O)COc1cccnc1 11a_106832991635_100015207166 [2,0,0,0,0,0|2,0,0]=4 3371 B12R1.27 CNC(=O)COc1cccnc1 1626a_100102657272_100015207166 [2,0,0,0,0,0|2,0,0]=4 3372 B12R1.27 CNC(=O)COc1cccnc1 240690a_100102657272_100015207166 [2,0,0,0,0,0|2,0,0]=4 3373 B12R1.27 CNC(=O)COc1cccnc1 34a_100000210849_100000183359 [2,0,0,0,0,0|2,0,0]=4 3374 B12R1.27 CNC(=O)COc1cccnc1 527a_100102657272_100015207166 [2,0,0,0,0,0|2,0,0]=4 3375 B12R1.27 CNC(=O)COc1cccnc1 7a_100000210849_100000183359 [2,0,0,0,0,0|2,0,0]=4 3376 B12R1.27 CNC(=O)COc1ccncc1 34a_100000212176_100000183359 [2,0,0,0,0,0|2,0,0]=4 3377 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [2,0,0,0,0,0|1,1,0]=4 3378 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [2,0,0,0,0,0|1,1,0]=4 3379 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [2,0,0,0,0,0|1,1,0]=4 3380 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [2,0,0,0,0,0|1,1,0]=4 3381 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [2,0,0,0,0,0|1,1,0]=4 3382 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [2,0,0,0,0,0|1,1,0]=4 3383 B12R1.27 COC(=O)CNc1ccccc1 34a_100000106764_100000747449 [2,0,0,0,0,0|1,0,0]=3 3384 B12R1.27 COC(=O)COc1ccccc1 34a_100000210340_100000747449 [2,0,0,0,0,0|0,0,0]=2 3385 B12R1.27 COC(=O)COc1ccccc1 7a_100000210340_100000747449 [2,0,0,0,0,0|0,0,0]=2 3386 B12R1.27 COC(=O)COc1cccnc1 34a_100000210849_100000747449 [2,0,0,0,0,0|1,0,0]=3 3387 B12R1.27 COC(=O)COc1cccnc1 7a_100000210849_100000747449 [2,0,0,0,0,0|1,0,0]=3 3388 B12R1.27 COC(=O)COc1ccncc1 34a_100000212176_100000747449 [2,0,0,0,0,0|1,0,0]=3 3389 B12R1.27 COC(=O)COc1ccnnc1 34a_100015204005_100000747449 [2,0,0,0,0,0|2,0,0]=4 3390 B12R1.27 COC(=O)COc1cncnc1 7a_100000754086_100000747449 [2,0,0,0,0,0|2,0,0]=4 3391 B12R1.27 COC(=O)CSc1ccccc1 62a_100000719477_100000747449 [2,0,0,0,0,0|0,1,0]=3 3392 B12R1.27 COC(=O)CSc1ccccc1 62a_100000747449_100000041952 [2,0,0,0,0,0|0,1,0]=3 3393 B12R1.27 COC(=O)CSc1ccccn1 62a_100000747449_100011216584 [2,0,0,0,0,0|1,1,0]=4 3394 B12R1.27 COC(=O)CSc1ccccn1 62a_100011216584_100000747449 [2,0,0,0,0,0|1,1,0]=4 3395 B12R1.27 COC(=O)CSc1cccnc1 62a_100000210063_100000747449 [2,0,0,0,0,0|1,1,0]=4 3396 B12R1.27 COC(=O)CSc1cccnc1 62a_100000747449_100000210063 [2,0,0,0,0,0|1,1,0]=4 3397 B12R1.27 COC(=O)CSc1ccncc1 62a_100000728582_100000747449 [2,0,0,0,0,0|1,1,0]=4 3398 B12R1.27 COC(=O)CSc1ccncc1 62a_100000747449_100000728582 [2,0,0,0,0,0|1,1,0]=4 3399 B12R1.27 COC(C)COc1ccccc1 34a_100000210911_200000210301 [2,0,0,0,0,0|1,0,1]=4 3400 B12R1.27 COC(C)COc1ccccc1 7a_100000210911_200000210301 [2,0,0,0,0,0|1,0,1]=4 3401 B12R1.27 O=C(CF)CCc1ccccc1 1458a_100000185753_100015361967 [2,0,0,0,0,0|2,0,0]=4 3402 B12R1.27 O=C(CF)COc1ccccc1 1458a_100000186222_100015361967 [2,0,0,0,0,0|1,0,0]=3 3403 B12R1.27 O=C(CF)COc1ccccn1 1458a_100102699861_100015361967 [2,0,0,0,0,0|2,0,0]=4 3404 B12R1.27 O=C(CF)COc1cccnc1 1458a_100015207166_100015361967 [2,0,0,0,0,0|2,0,0]=4 3405 B12R1.27 O=C(CF)CSc1ccccc1 1458a_100000211596_100015361967 [2,0,0,0,0,0|1,1,0]=4 3406 B12R1.27 O=C(CO)CCc1ccccc1 1458a_100000210174_100000765856 [2,0,0,0,0,0|2,0,0]=4 3407 B14R0.10 C=CCOC(=O)COC(CC=C)CC=C 7a_100011215198_100000033060 [0,1,1,0,0,0|0,0,2]=4 3408 B14R1.14 C=CCCCCOc1ccc(cc1)Br 34a_100000185759_100011215482 [1,1,0,0,0,0|1,0,1]=4 3409 B14R1.14 C=CCCCCOc1ccc(cc1)Br 7a_100000185759_100011215482 [1,1,0,0,0,0|1,0,1]=4 3410 B14R1.14 C=CCCCCOc1ccc(cc1)C 34a_100000210336_100011215482 [1,1,0,0,0,0|1,0,1]=4 3411 B14R1.14 C=CCCCCOc1ccc(cc1)C 7a_100000210336_100011215482 [1,1,0,0,0,0|1,0,1]=4 3412 B14R1.14 C=CCCCCOc1ccc(cc1)Cl 34a_100000210216_100011215482 [1,1,0,0,0,0|1,0,1]=4 3413 B14R1.14 C=CCCCCOc1ccc(cc1)Cl 7a_100000210216_100011215482 [1,1,0,0,0,0|1,0,1]=4 3414 B14R1.14 C=CCCCCOc1ccc(cc1)F 34a_100000210339_100011215482 [1,1,0,0,0,0|1,0,1]=4 3415 B14R1.14 C=CCCCCOc1ccc(cc1)I 34a_100000212066_100011215482 [1,1,0,0,0,0|1,0,1]=4 3416 B14R1.14 C=CCCCCOc1ccc(cc1)I 7a_100000212066_100011215482 [1,1,0,0,0,0|1,0,1]=4 3417 B14R1.14 C=CCCCCOc1ccc(cc1)N 34a_100000185829_100011215482 [1,1,0,0,0,0|1,0,1]=4 3418 B14R1.14 C=CCNCCOc1ccc(cc1)Br 2230a_100000746992_100000210623 [1,1,0,0,0,0|1,0,1]=4 3419 B14R1.14 C=CCNCCOc1ccc(cc1)Br 2230a_100020586998_100000183278 [1,1,0,0,0,0|1,0,1]=4 3420 B14R1.14 C=CCNCCOc1ccc(cc1)Br 34a_100000746992_100015514636 [1,1,0,0,0,0|1,0,1]=4 3421 B14R1.14 C=CCNCCOc1ccc(cc1)C 2230a_100020586998_100000183172 [1,1,0,0,0,0|1,0,1]=4 3422 B14R1.14 C=CCNCCOc1ccc(cc1)C 2230a_100020666663_100000210623 [1,1,0,0,0,0|1,0,1]=4 3423 B14R1.14 C=CCNCCOc1ccc(cc1)C 34a_100020666663_100015514636 [1,1,0,0,0,0|1,0,1]=4 3424 B14R1.14 C=CCNCCOc1ccc(cc1)Cl 2230a_100000697975_100000210623 [1,1,0,0,0,0|1,0,1]=4 3425 B14R1.14 C=CCNCCOc1ccc(cc1)Cl 2230a_100020586998_100000184122 [1,1,0,0,0,0|1,0,1]=4 3426 B14R1.14 C=CCNCCOc1ccc(cc1)Cl 34a_100000697975_100015514636 [1,1,0,0,0,0|1,0,1]=4 3427 B14R1.14 C=CCNCCOc1ccc(cc1)F 2230a_100000737420_100000210623 [1,1,0,0,0,0|1,0,1]=4 3428 B14R1.14 C=CCNCCOc1ccc(cc1)F 2230a_100020586998_100000184936 [1,1,0,0,0,0|1,0,1]=4 3429 B14R1.14 C=CCNCCOc1ccc(cc1)F 34a_100000737420_100015514636 [1,1,0,0,0,0|1,0,1]=4 3430 B14R1.14 C=CCOCCCc1ccc(cc1)Br 34a_100011709247_100015514636 [1,1,0,0,0,0|1,0,1]=4 3431 B14R1.14 C=CCOCCCc1ccc(cc1)Br 34a_200000210373_100011713682 [1,1,0,0,0,0|1,0,1]=4 3432 B14R1.14 C=CCOCCCc1ccc(cc1)Br 7a_100011709247_100015514636 [1,1,0,0,0,0|1,0,1]=4 3433 B14R1.14 C=CCOCCCc1ccc(cc1)C 34a_100000189427_100015514636 [1,1,0,0,0,0|1,0,1]=4 3434 B14R1.14 C=CCOCCCc1ccc(cc1)C 7a_100000189427_100015514636 [1,1,0,0,0,0|1,0,1]=4 3435 B14R1.14 C=CCOCCCc1ccc(cc1)Cl 34a_100011217485_100015514636 [1,1,0,0,0,0|1,0,1]=4 3436 B14R1.14 C=CCOCCCc1ccc(cc1)Cl 34a_200000210373_100000759440 [1,1,0,0,0,0|1,0,1]=4 3437 B14R1.14 C=CCOCCCc1ccc(cc1)Cl 7a_100011217485_100015514636 [1,1,0,0,0,0|1,0,1]=4 3438 B14R1.14 C=CCOCCCc1ccc(cc1)F 34a_100000757351_100015514636 [1,1,0,0,0,0|1,0,1]=4 3439 B14R1.14 C=CCOCCCc1ccc(cc1)F 34a_200000210373_200011713563 [1,1,0,0,0,0|1,0,1]=4 3440 B14R1.14 C=CCOCCCc1ccc(cc1)F 7a_100000757351_100015514636 [1,1,0,0,0,0|1,0,1]=4 3441 B14R1.14 C=CCOCCOc1ccc(cc1)Br 34a_100000686261_100015514636 [1,1,0,0,0,0|0,0,1]=3 3442 B14R1.14 C=CCOCCOc1ccc(cc1)Br 34a_200000210373_100000183278 [1,1,0,0,0,0|0,0,1]=3 3443 B14R1.14 C=CCOCCOc1ccc(cc1)Br 7a_100000686261_100015514636 [1,1,0,0,0,0|0,0,1]=3 3444 B14R1.14 C=CCOCCOc1ccc(cc1)C 34a_100011219107_100015514636 [1,1,0,0,0,0|0,0,1]=3 3445 B14R1.14 C=CCOCCOc1ccc(cc1)C 34a_200000210373_100000183172 [1,1,0,0,0,0|0,0,1]=3 3446 B14R1.14 C=CCOCCOc1ccc(cc1)C 7a_100011219107_100015514636 [1,1,0,0,0,0|0,0,1]=3 3447 B14R1.14 C=CCOCCOc1ccc(cc1)Cl 34a_100000237962_100015514636 [1,1,0,0,0,0|0,0,1]=3 3448 B14R1.14 C=CCOCCOc1ccc(cc1)Cl 34a_200000210373_100000184122 [1,1,0,0,0,0|0,0,1]=3 3449 B14R1.14 C=CCOCCOc1ccc(cc1)Cl 7a_100000237962_100015514636 [1,1,0,0,0,0|0,0,1]=3 3450 B14R1.14 C=CCOCCOc1ccc(cc1)F 34a_200000210373_100000184936 [1,1,0,0,0,0|0,0,1]=3 3451 B14R1.14 C=CCOCCOc1ccc(cc1)N 34a_100000754363_100015514636 [1,1,0,0,0,0|0,0,1]=3 3452 B14R1.14 C=CCOCCOc1ccc(cn1)N 34a_100102662783_100015514636 [1,1,0,0,0,0|1,0,1]=4 3453 B14R1.14 C=CCOCCOc1ccc(nc1)Br 34a_200013150534_100015514636 [1,1,0,0,0,0|1,0,1]=4 3454 B14R1.14 C=CCOCCOc1ccc(nc1)Br 7a_200013150534_100015514636 [1,1,0,0,0,0|1,0,1]=4 3455 B14R1.14 C=CCOCCSc1ccc(cc1)C 34a_200000230582_100015514636 [1,1,0,0,0,0|0,1,1]=4 3456 B14R1.14 C=CCOCCSc1ccc(cc1)C 7a_200000230582_100015514636 [1,1,0,0,0,0|0,1,1]=4 3457 B14R1.14 C=CCOCCSc1ccc(cc1)Cl 34a_100000230527_100015514636 [1,1,0,0,0,0|0,1,1]=4 3458 B14R1.14 C=CCOCCSc1ccc(cc1)Cl 7a_100000230527_100015514636 [1,1,0,0,0,0|0,1,1]=4 3459 B14R1.14 C=CCOCCSc1ccc(cc1)F 34a_200000230679_100015514636 [1,1,0,0,0,0|0,1,1]=4 3460 B14R1.14 C=CCOCCSc1ccc(cc1)F 7a_200000230679_100015514636 [1,1,0,0,0,0|0,1,1]=4 3461 B14R1.14 C=CCSCCOc1ccc(cc1)Br 62a_100000183278_100000210623 [1,1,0,0,0,0|0,1,1]=4 3462 B14R1.14 C=CCSCCOc1ccc(cc1)Br 62a_100000210623_100000183278 [1,1,0,0,0,0|0,1,1]=4 3463 B14R1.14 C=CCSCCOc1ccc(cc1)C 62a_100000183172_100000210623 [1,1,0,0,0,0|0,1,1]=4 3464 B14R1.14 C=CCSCCOc1ccc(cc1)C 62a_100000210623_100000183172 [1,1,0,0,0,0|0,1,1]=4 3465 B14R1.14 C=CCSCCOc1ccc(cc1)Cl 62a_100000184122_100000210623 [1,1,0,0,0,0|0,1,1]=4 3466 B14R1.14 C=CCSCCOc1ccc(cc1)Cl 62a_100000210623_100000184122 [1,1,0,0,0,0|0,1,1]=4 3467 B14R1.14 C=CCSCCOc1ccc(cc1)F 62a_100000184936_100000210623 [1,1,0,0,0,0|0,1,1]=4 3468 B14R1.14 C=CCSCCOc1ccc(cc1)F 62a_100000210623_100000184936 [1,1,0,0,0,0|0,1,1]=4 3469 B14R1.14 Cc1ccc(cc1)OCCOCC=O 34a_100011219107_200009817547 [1,1,0,0,0,0|1,0,1]=4 3470 B14R1.14 Cc1ccc(cc1)OCCOCC=O 7a_100011219107_200015260668 [1,1,0,0,0,0|1,0,1]=4 3471 B14R1.14 Nc1ccc(cc1)OCCOCC=O 34a_100000754363_200009817547 [1,1,0,0,0,0|1,0,1]=4 3472 B14R1.14 O=CCOCCOc1ccc(cc1)Br 34a_100000686261_200009817547 [1,1,0,0,0,0|1,0,1]=4 3473 B14R1.14 O=CCOCCOc1ccc(cc1)Br 7a_100000686261_200015260668 [1,1,0,0,0,0|1,0,1]=4 3474 B14R1.14 O=CCOCCOc1ccc(cc1)Cl 34a_100000237962_200009817547 [1,1,0,0,0,0|1,0,1]=4 3475 B14R1.14 O=CCOCCOc1ccc(cc1)Cl 7a_100000237962_200015260668 [1,1,0,0,0,0|1,0,1]=4 3476 B14R1.26 C=CCCCCOc1cccc(c1)Br 34a_100000210342_100011215482 [1,1,0,0,0,0|1,0,1]=4 3477 B14R1.26 C=CCCCCOc1cccc(c1)Br 7a_100000210342_100011215482 [1,1,0,0,0,0|1,0,1]=4 3478 B14R1.26 C=CCCCCOc1cccc(c1)C 34a_100000210337_100011215482 [1,1,0,0,0,0|1,0,1]=4 3479 B14R1.26 C=CCCCCOc1cccc(c1)C 7a_100000210337_100011215482 [1,1,0,0,0,0|1,0,1]=4 3480 B14R1.26 C=CCCCCOc1cccc(c1)Cl 34a_100000210295_100011215482 [1,1,0,0,0,0|1,0,1]=4 3481 B14R1.26 C=CCCCCOc1cccc(c1)Cl 7a_100000210295_100011215482 [1,1,0,0,0,0|1,0,1]=4 3482 B14R1.26 C=CCCCCOc1cccc(c1)F 34a_100000210426_100011215482 [1,1,0,0,0,0|1,0,1]=4 3483 B14R1.26 C=CCCCCOc1cccc(c1)F 7a_100000210426_100011215482 [1,1,0,0,0,0|1,0,1]=4 3484 B14R1.26 C=CCCCCOc1cccc(c1)I 34a_100000211634_100011215482 [1,1,0,0,0,0|1,0,1]=4 3485 B14R1.26 C=CCCCCOc1cccc(c1)I 7a_100000211634_100011215482 [1,1,0,0,0,0|1,0,1]=4 3486 B14R1.26 C=CCCCCOc1cccc(c1)N 34a_100000210217_100011215482 [1,1,0,0,0,0|1,0,1]=4 3487 B14R1.26 C=CCNCCOc1cccc(c1)Br 2230a_100000743521_100000210623 [1,1,0,0,0,0|1,0,1]=4 3488 B14R1.26 C=CCNCCOc1cccc(c1)Br 2230a_100020586998_100000183150 [1,1,0,0,0,0|1,0,1]=4 3489 B14R1.26 C=CCNCCOc1cccc(c1)Br 34a_100000743521_100015514636 [1,1,0,0,0,0|1,0,1]=4 3490 B14R1.26 C=CCNCCOc1cccc(c1)C 2230a_100015185188_100000210623 [1,1,0,0,0,0|1,0,1]=4 3491 B14R1.26 C=CCNCCOc1cccc(c1)C 34a_100015185188_100015514636 [1,1,0,0,0,0|1,0,1]=4 3492 B14R1.26 C=CCNCCOc1cccc(c1)Cl 2230a_100000740232_100000210623 [1,1,0,0,0,0|1,0,1]=4 3493 B14R1.26 C=CCNCCOc1cccc(c1)Cl 2230a_100020586998_100000181161 [1,1,0,0,0,0|1,0,1]=4 3494 B14R1.26 C=CCNCCOc1cccc(c1)Cl 34a_100000740232_100015514636 [1,1,0,0,0,0|1,0,1]=4 3495 B14R1.26 C=CCNCCOc1cccc(c1)F 2230a_100000738948_100000210623 [1,1,0,0,0,0|1,0,1]=4 3496 B14R1.26 C=CCNCCOc1cccc(c1)F 2230a_100020586998_100000739188 [1,1,0,0,0,0|1,0,1]=4 3497 B14R1.26 C=CCNCCOc1cccc(c1)F 34a_100000738948_100015514636 [1,1,0,0,0,0|1,0,1]=4 3498 B14R1.26 C=CCOCCCc1cccc(c1)Br 34a_100011709248_100015514636 [1,1,0,0,0,0|1,0,1]=4 3499 B14R1.26 C=CCOCCCc1cccc(c1)Br 34a_200000210373_100011713683 [1,1,0,0,0,0|1,0,1]=4 3500 B14R1.26 C=CCOCCCc1cccc(c1)Br 7a_100011709248_100015514636 [1,1,0,0,0,0|1,0,1]=4 3501 B14R1.26 C=CCOCCCc1cccc(c1)Cl 34a_100011709246_100015514636 [1,1,0,0,0,0|1,0,1]=4 3502 B14R1.26 C=CCOCCCc1cccc(c1)Cl 7a_100011709246_100015514636 [1,1,0,0,0,0|1,0,1]=4 3503 B14R1.26 C=CCOCCCc1cccc(c1)F 34a_200000210373_200000698031 [1,1,0,0,0,0|1,0,1]=4 3504 B14R1.26 C=CCOCCCc1cccc(c1)N 34a_200000698965_100015514636 [1,1,0,0,0,0|1,0,1]=4 3505 B14R1.26 C=CCOCCCc1cccc(c1)N 7a_200000698965_100015514636 [1,1,0,0,0,0|1,0,1]=4 3506 B14R1.26 C=CCOCCOc1cccc(c1)Br 34a_100000757546_100015514636 [1,1,0,0,0,0|0,0,1]=3 3507 B14R1.26 C=CCOCCOc1cccc(c1)Br 34a_200000210373_100000183150 [1,1,0,0,0,0|0,0,1]=3 3508 B14R1.26 C=CCOCCOc1cccc(c1)Br 7a_100000757546_100015514636 [1,1,0,0,0,0|0,0,1]=3 3509 B14R1.26 C=CCOCCOc1cccc(c1)C 34a_200011215094_100015514636 [1,1,0,0,0,0|0,0,1]=3 3510 B14R1.26 C=CCOCCOc1cccc(c1)C 7a_200011215094_100015514636 [1,1,0,0,0,0|0,0,1]=3 3511 B14R1.26 C=CCOCCOc1cccc(c1)Cl 34a_100000230539_100015514636 [1,1,0,0,0,0|0,0,1]=3 3512 B14R1.26 C=CCOCCOc1cccc(c1)Cl 34a_200000210373_100000181161 [1,1,0,0,0,0|0,0,1]=3 3513 B14R1.26 C=CCOCCOc1cccc(c1)Cl 7a_100000230539_100015514636 [1,1,0,0,0,0|0,0,1]=3 3514 B14R1.26 C=CCOCCOc1cccc(c1)F 34a_200000210373_100000739188 [1,1,0,0,0,0|0,0,1]=3 3515 B14R1.26 C=CCOCCOc1cccc(c1)N 34a_100011232151_100015514636 [1,1,0,0,0,0|0,0,1]=3 3516 B14R1.26 C=CCOCCSc1cccc(c1)Br 7a_200011756134_100015514636 [1,1,0,0,0,0|0,1,1]=4 3517 B14R1.26 C=CCOCCSc1cccc(c1)C 34a_200011432187_100015514636 [1,1,0,0,0,0|0,1,1]=4 3518 B14R1.26 C=CCOCCSc1cccc(c1)C 7a_200011432187_100015514636 [1,1,0,0,0,0|0,1,1]=4 3519 B14R1.26 C=CCOCCSc1cccc(c1)Cl 34a_200011721761_100015514636 [1,1,0,0,0,0|0,1,1]=4 3520 B14R1.26 C=CCOCCSc1cccc(c1)Cl 7a_200011721761_100015514636 [1,1,0,0,0,0|0,1,1]=4 3521 B14R1.26 C=CCOCCSc1cccc(c1)F 34a_200011996949_100015514636 [1,1,0,0,0,0|0,1,1]=4 3522 B14R1.26 C=CCOCCSc1cccc(c1)F 7a_200011996949_100015514636 [1,1,0,0,0,0|0,1,1]=4 3523 B14R1.26 C=CCSCCOc1cccc(c1)Br 62a_100000183150_100000210623 [1,1,0,0,0,0|0,1,1]=4 3524 B14R1.26 C=CCSCCOc1cccc(c1)Br 62a_100000210623_100000183150 [1,1,0,0,0,0|0,1,1]=4 3525 B14R1.26 C=CCSCCOc1cccc(c1)Cl 62a_100000181161_100000210623 [1,1,0,0,0,0|0,1,1]=4 3526 B14R1.26 C=CCSCCOc1cccc(c1)Cl 62a_100000210623_100000181161 [1,1,0,0,0,0|0,1,1]=4 3527 B14R1.26 C=CCSCCOc1cccc(c1)F 62a_100000210623_100000739188 [1,1,0,0,0,0|0,1,1]=4 3528 B14R1.26 C=CCSCCOc1cccc(c1)F 62a_100000739188_100000210623 [1,1,0,0,0,0|0,1,1]=4 3529 B14R1.26 Cc1cccc(c1)OCCOCC=O 34a_200011215094_200009817547 [1,1,0,0,0,0|1,0,1]=4 3530 B14R1.26 Cc1cccc(c1)OCCOCC=O 7a_200011215094_200015260668 [1,1,0,0,0,0|1,0,1]=4 3531 B14R1.26 Nc1cccc(c1)OCCOCC=O 34a_100011232151_200009817547 [1,1,0,0,0,0|1,0,1]=4 3532 B14R1.26 O=CCOCCOc1cccc(c1)Br 34a_100000757546_200009817547 [1,1,0,0,0,0|1,0,1]=4 3533 B14R1.26 O=CCOCCOc1cccc(c1)Br 7a_100000757546_200015260668 [1,1,0,0,0,0|1,0,1]=4 3534 B14R1.26 O=CCOCCOc1cccc(c1)Cl 34a_100000230539_200009817547 [1,1,0,0,0,0|1,0,1]=4 3535 B14R1.26 O=CCOCCOc1cccc(c1)Cl 7a_100000230539_200015260668 [1,1,0,0,0,0|1,0,1]=4 3536 B14R1.38 C=CCOCC[C@@H](O)c1ccccc1 34a_200000210373_100000729684 [1,1,0,0,0,0|1,0,1]=4 3537 B14R1.38 C=CCOCC[C@H](N)c1ccccc1 34a_100025705951_100015514636 [1,1,0,0,0,0|1,0,1]=4 3538 B14R1.123 C/C=C/CNCCOc1ccccc1 34a_100000174943_100102629194 [1,1,0,0,0,0|1,0,1]=4 3539 B14R1.123 C/C=C/COCCCc1ccccc1 34a_100000210828_100102629194 [1,1,0,0,0,0|1,0,1]=4 3540 B14R1.123 C/C=C/COCCCc1ccccc1 34a_100016270725_100000211621 [1,1,0,0,0,0|1,0,1]=4 3541 B14R1.123 C/C=C/COCCCc1ccccc1 7a_100000210828_100102629194 [1,1,0,0,0,0|1,0,1]=4 3542 B14R1.123 C/C=C/COCCNc1ccccc1 34a_100000211345_100102629194 [1,1,0,0,0,0|1,0,1]=4 3543 B14R1.123 C/C=C/COCCOc1ccccc1 34a_100000210260_100102629194 [1,1,0,0,0,0|0,0,1]=3 3544 B14R1.123 C/C=C/COCCOc1ccccc1 34a_100016270725_100000184471 [1,1,0,0,0,0|0,0,1]=3 3545 B14R1.123 C/C=C/COCCOc1ccccc1 7a_100000210260_100102629194 [1,1,0,0,0,0|0,0,1]=3 3546 B14R1.123 C/C=C/COCCSc1ccccc1 34a_100016270725_100000246102 [1,1,0,0,0,0|0,1,1]=4 3547 B14R1.123 C/C=C/COCCSc1ccccc1 7a_100000230494_100102629194 [1,1,0,0,0,0|0,1,1]=4 3548 B14R1.123 C/C=C/CSCCOc1ccccc1 62a_100000184471_100102629194 [1,1,0,0,0,0|0,1,1]=4 3549 B14R1.123 C/C=C/CSCCOc1ccccc1 62a_100102629194_100000184471 [1,1,0,0,0,0|0,1,1]=4 3550 B14R1.123 C=CCCCCCOc1ccccc1 34a_100000210340_100000700193 [1,1,0,0,0,0|1,0,1]=4 3551 B14R1.123 C=CCCCCCOc1ccccc1 7a_100000210340_100000700193 [1,1,0,0,0,0|1,0,1]=4 3552 B14R1.123 C=CCCCCOCc1ccccc1 34a_100000210790_100011215482 [1,1,0,0,0,0|1,0,1]=4 3553 B14R1.123 C=CCCCCOCc1ccccc1 34a_100000766645_100015291786 [1,1,0,0,0,0|1,0,1]=4 3554 B14R1.123 C=CCCCCOCc1ccccc1 7a_100000210790_100011215482 [1,1,0,0,0,0|1,0,1]=4 3555 B14R1.123 C=CCCCCOCc1ccccc1 7a_100000766645_100000211182 [1,1,0,0,0,0|1,0,1]=4 3556 B14R1.123 C=CCCNCCOc1ccccc1 2230a_100000174943_100000754431 [1,1,0,0,0,0|1,0,1]=4 3557 B14R1.123 C=CCCNCCOc1ccccc1 2230a_100015191253_100000184471 [1,1,0,0,0,0|1,0,1]=4 3558 B14R1.123 C=CCCNCCOc1ccccc1 270004a_100015191253_100000758736 [1,1,0,0,0,0|1,0,1]=4 3559 B14R1.123 C=CCCNCCOc1ccccc1 34a_100000174943_100000754431 [1,1,0,0,0,0|1,0,1]=4 3560 B14R1.123 C=CCCNCOCc1ccccc1 2230a_100015191253_100000763385 [1,1,0,0,0,0|2,0,0]=4 3561 B14R1.123 C=CCCOCCCc1ccccc1 34a_100000210828_100000754431 [1,1,0,0,0,0|1,0,1]=4 3562 B14R1.123 C=CCCOCCCc1ccccc1 34a_100011205117_100000211621 [1,1,0,0,0,0|1,0,1]=4 3563 B14R1.123 C=CCCOCCCc1ccccc1 7a_100000210828_100000754431 [1,1,0,0,0,0|1,0,1]=4 3564 B14R1.123 C=CCCOCCNc1ccccc1 34a_100000211345_100000754431 [1,1,0,0,0,0|1,0,1]=4 3565 B14R1.123 C=CCCOCCOc1ccccc1 34a_100000210260_100000754431 [1,1,0,0,0,0|0,0,1]=3 3566 B14R1.123 C=CCCOCCOc1ccccc1 34a_100011205117_100000184471 [1,1,0,0,0,0|0,0,1]=3 3567 B14R1.123 C=CCCOCCOc1ccccc1 7a_100000210260_100000754431 [1,1,0,0,0,0|0,0,1]=3 3568 B14R1.123 C=CCCOCCSc1ccccc1 34a_100011205117_100000246102 [1,1,0,0,0,0|0,1,1]=4 3569 B14R1.123 C=CCCOCCSc1ccccc1 7a_100000230494_100000754431 [1,1,0,0,0,0|0,1,1]=4 3570 B14R1.123 C=CCCOCOCc1ccccc1 34a_100011205117_100000763385 [1,1,0,0,0,0|2,0,0]=4 3571 B14R1.123 C=CCCSCCOc1ccccc1 62a_100000184471_100000754431 [1,1,0,0,0,0|0,1,1]=4 3572 B14R1.123 C=CCCSCCOc1ccccc1 62a_100000754431_100000184471 [1,1,0,0,0,0|0,1,1]=4 3573 B14R1.123 C=CCCSCOCc1ccccc1 62a_100000754431_100000763385 [1,1,0,0,0,0|2,0,0]=4 3574 B14R1.123 C=CCCSCOCc1ccccc1 62a_100000763385_100000754431 [1,1,0,0,0,0|2,0,0]=4 3575 B14R1.123 C=CCNCCCOc1ccccc1 2230a_100000216521_100000210623 [1,1,0,0,0,0|1,0,1]=4 3576 B14R1.123 C=CCNCCCOc1ccccc1 2230a_100020586998_100000199009 [1,1,0,0,0,0|1,0,1]=4 3577 B14R1.123 C=CCNCCCOc1ccccc1 34a_100000216521_100015514636 [1,1,0,0,0,0|1,0,1]=4 3578 B14R1.123 C=CCNCCOCc1ccccc1 2230a_100000753106_100000210623 [1,1,0,0,0,0|1,0,1]=4 3579 B14R1.123 C=CCNCCOCc1ccccc1 2230a_100020586998_100000234347 [1,1,0,0,0,0|1,0,1]=4 3580 B14R1.123 C=CCNCCOCc1ccccc1 34a_100000753106_100015514636 [1,1,0,0,0,0|1,0,1]=4 3581 B14R1.123 C=CCOCCC#Cc1ccccc1 34a_100000760064_100015514636 [1,1,0,0,0,0|1,0,1]=4 3582 B14R1.123 C=CCOCCC#Cc1ccccc1 7a_100000760064_100015514636 [1,1,0,0,0,0|1,0,1]=4 3583 B14R1.123 C=CCOCCCCc1ccccc1 34a_100000703073_100015514636 [1,1,0,0,0,0|1,0,1]=4 3584 B14R1.123 C=CCOCCCCc1ccccc1 34a_200000210373_100000701786 [1,1,0,0,0,0|1,0,1]=4 3585 B14R1.123 C=CCOCCCCc1ccccc1 7a_100000703073_100015514636 [1,1,0,0,0,0|1,0,1]=4 3586 B14R1.123 C=CCOCCCNc1ccccc1 34a_100000212590_100015514636 [1,1,0,0,0,0|1,0,1]=4 3587 B14R1.123 C=CCOCCCOc1ccccc1 34a_100011215863_100015514636 [1,1,0,0,0,0|0,0,1]=3 3588 B14R1.123 C=CCOCCCOc1ccccc1 34a_200000210373_100000199009 [1,1,0,0,0,0|0,0,1]=3 3589 B14R1.123 C=CCOCCCOc1ccccc1 7a_100011215863_100015514636 [1,1,0,0,0,0|0,0,1]=3 3590 B14R1.123 C=CCOCCCSc1ccccc1 34a_200000210373_200011203293 [1,1,0,0,0,0|0,1,1]=4 3591 B14R1.123 C=CCOCCNCc1ccccc1 34a_100000180844_100015514636 [1,1,0,0,0,0|1,0,1]=4 3592 B14R1.123 C=CCOCCOCc1ccccc1 34a_100000037705_100015291786 [1,1,0,0,0,0|0,0,1]=3 3593 B14R1.123 C=CCOCCOCc1ccccc1 34a_100000759325_100015514636 [1,1,0,0,0,0|0,0,1]=3 3594 B14R1.123 C=CCOCCOCc1ccccc1 34a_200000210373_100000234347 [1,1,0,0,0,0|0,0,1]=3 3595 B14R1.123 C=CCOCCOCc1ccccc1 7a_100000037705_100000211182 [1,1,0,0,0,0|0,0,1]=3 3596 B14R1.123 C=CCOCCOCc1ccccc1 7a_100000759325_100015514636 [1,1,0,0,0,0|0,0,1]=3 3597 B14R1.123 C=CCOCCOCc1ccccn1 34a_100000037705_100000721315 [1,1,0,0,0,0|1,0,1]=4 3598 B14R1.123 C=CCOCCOCc1ccccn1 7a_100000037705_100000721315 [1,1,0,0,0,0|1,0,1]=4 3599 B14R1.123 C=CCOCCOCc1cccnc1 34a_100000037705_100000733263 [1,1,0,0,0,0|1,0,1]=4 3600 B14R1.123 C=CCOCCOCc1cccnc1 7a_100000037705_100000741622 [1,1,0,0,0,0|1,0,1]=4 3601 B14R1.123 C=CCOCCOCc1ccncc1 7a_100000037705_100015193705 [1,1,0,0,0,0|1,0,1]=4 3602 B14R1.123 C=CCOCCSCc1ccccc1 34a_100011205989_100015514636 [1,1,0,0,0,0|0,1,1]=4 3603 B14R1.123 C=CCOCCSCc1ccccc1 34a_200000210373_200011297719 [1,1,0,0,0,0|0,1,1]=4 3604 B14R1.123 C=CCOCCSCc1ccccc1 7a_100011205989_100015514636 [1,1,0,0,0,0|0,1,1]=4 3605 B14R1.123 C=CCSCCCOc1ccccc1 62a_100000199009_100000210623 [1,1,0,0,0,0|0,1,1]=4 3606 B14R1.123 C=CCSCCCOc1ccccc1 62a_100000210623_100000199009 [1,1,0,0,0,0|0,1,1]=4 3607 B14R1.123 C=CCSCCOCc1ccccc1 62a_100000210623_100000234347 [1,1,0,0,0,0|0,1,1]=4 3608 B14R1.123 C=CCSCCOCc1ccccc1 62a_100000234347_100000210623 [1,1,0,0,0,0|0,1,1]=4 3609 B14R1.123 CC=CCNCCOc1ccccc1 2230a_100000174943_100000070051 [1,1,0,0,0,0|1,0,1]=4 3610 B14R1.123 CC=CCNCCOc1ccccc1 34a_100000174943_100000070051 [1,1,0,0,0,0|1,0,1]=4 3611 B14R1.123 CC=CCOCCCc1ccccc1 34a_100000210828_100000070051 [1,1,0,0,0,0|1,0,1]=4 3612 B14R1.123 CC=CCOCCCc1ccccc1 7a_100000210828_100000070051 [1,1,0,0,0,0|1,0,1]=4 3613 B14R1.123 CC=CCOCCNc1ccccc1 34a_100000211345_100000070051 [1,1,0,0,0,0|1,0,1]=4 3614 B14R1.123 CC=CCOCCOc1ccccc1 34a_100000210260_100000070051 [1,1,0,0,0,0|0,0,1]=3 3615 B14R1.123 CC=CCOCCOc1ccccc1 7a_100000210260_100000070051 [1,1,0,0,0,0|0,0,1]=3 3616 B14R1.123 CC=CCOCCSc1ccccc1 7a_100000230494_100000070051 [1,1,0,0,0,0|0,1,1]=4 3617 B14R1.123 CC=CCSCCOc1ccccc1 62a_100000070051_100000184471 [1,1,0,0,0,0|0,1,1]=4 3618 B14R1.123 CC=CCSCCOc1ccccc1 62a_100000184471_100000070051 [1,1,0,0,0,0|0,1,1]=4 3619 B14R1.123 O=CCOCCCOc1ccccc1 34a_100011215863_200009817547 [1,1,0,0,0,0|1,0,1]=4 3620 B14R1.123 O=CCOCCCOc1ccccc1 7a_100011215863_200015260668 [1,1,0,0,0,0|1,0,1]=4 3621 B14R1.123 O=CCOCCOCc1ccccc1 34a_100000759325_200009817547 [1,1,0,0,0,0|1,0,1]=4 3622 B14R1.123 O=CCOCCOCc1ccccc1 7a_100000759325_200015260668 [1,1,0,0,0,0|1,0,1]=4 3623 B14R1.158 C=CCNCC(C)Oc1ccccc1 2230a_100000755676_100000210623 [1,1,0,0,0,0|1,0,1]=4 3624 B14R1.158 C=CCNCC(C)Oc1ccccc1 34a_100000755676_100015514636 [1,1,0,0,0,0|1,0,1]=4 3625 B14R1.158 C=CCOCC(=O)Oc1ccccc1 34a_200000210373_100009813826 [1,1,0,0,0,0|0,0,2]=4 3626 B14R1.158 C=CCOCC(C)Cc1ccccc1 34a_100012125295_100015514636 [1,1,0,0,0,0|1,0,1]=4 3627 B14R1.158 C=CCOCC(C)Cc1ccccc1 7a_100012125295_100015514636 [1,1,0,0,0,0|1,0,1]=4 3628 B14R1.158 C=CCOCC(C)Oc1ccccc1 34a_200000036796_100015514636 [1,1,0,0,0,0|0,0,1]=3 3629 B14R1.158 C=CCOCC(C)Oc1ccccc1 7a_200000036796_100015514636 [1,1,0,0,0,0|0,0,1]=3 3630 B14R1.158 C=CCOCC(N)Cc1ccccc1 34a_100000739027_100015514636 [1,1,0,0,0,0|1,0,1]=4 3631 B14R1.158 C=CCOC[C@@H](O)Cc1ccccc1 34a_200000210373_100000729385 [1,1,0,0,0,0|1,0,1]=4 3632 B14R1.158 CC(COCC=O)Oc1ccccc1 34a_200000036796_200009817547 [1,1,0,0,0,0|1,0,1]=4 3633 B14R1.158 CC(COCC=O)Oc1ccccc1 7a_200000036796_200015260668 [1,1,0,0,0,0|1,0,1]=4 3634 B14R1.422 C=C(C)CNCCOc1ccccc1 2230a_100000174943_100000748629 [1,1,0,0,0,0|1,0,1]=4 3635 B14R1.422 C=C(C)CNCCOc1ccccc1 34a_100000174943_100000748629 [1,1,0,0,0,0|1,0,1]=4 3636 B14R1.422 C=C(C)COCCCc1ccccc1 34a_100000210245_100000211621 [1,1,0,0,0,0|1,0,1]=4 3637 B14R1.422 C=C(C)COCCCc1ccccc1 34a_100000210828_100000748629 [1,1,0,0,0,0|1,0,1]=4 3638 B14R1.422 C=C(C)COCCCc1ccccc1 7a_100000210828_100000748629 [1,1,0,0,0,0|1,0,1]=4 3639 B14R1.422 C=C(C)COCCNc1ccccc1 34a_100000211345_100000748629 [1,1,0,0,0,0|1,0,1]=4 3640 B14R1.422 C=C(C)COCCOc1ccccc1 34a_100000210245_100000184471 [1,1,0,0,0,0|0,0,1]=3 3641 B14R1.422 C=C(C)COCCOc1ccccc1 34a_100000210260_100000748629 [1,1,0,0,0,0|0,0,1]=3 3642 B14R1.422 C=C(C)COCCOc1ccccc1 7a_100000210260_100000748629 [1,1,0,0,0,0|0,0,1]=3 3643 B14R1.422 C=C(C)COCCSc1ccccc1 34a_100000210245_100000246102 [1,1,0,0,0,0|0,1,1]=4 3644 B14R1.422 C=C(C)COCCSc1ccccc1 7a_100000230494_100000748629 [1,1,0,0,0,0|0,1,1]=4 3645 B14R1.422 C=C(C)CSCCOc1ccccc1 62a_100000184471_100000211660 [1,1,0,0,0,0|0,1,1]=4 3646 B14R1.422 C=C(C)CSCCOc1ccccc1 62a_100000748629_100000184471 [1,1,0,0,0,0|0,1,1]=4 3647 B14R1.422 C=C(F)CNCCOc1ccccc1 2230a_100000174943_100009893438 [1,1,0,0,0,0|1,0,1]=4 3648 B14R1.422 C=C(F)CNCCOc1ccccc1 34a_100000174943_100009893438 [1,1,0,0,0,0|1,0,1]=4 3649 B14R1.422 C=C(F)COCCCc1ccccc1 34a_100000210828_100009893438 [1,1,0,0,0,0|1,0,1]=4 3650 B14R1.422 C=C(F)COCCCc1ccccc1 34a_200010262243_100000211621 [1,1,0,0,0,0|1,0,1]=4 3651 B14R1.422 C=C(F)COCCCc1ccccc1 7a_100000210828_100000042424 [1,1,0,0,0,0|1,0,1]=4 3652 B14R1.422 C=C(F)COCCNc1ccccc1 34a_100000211345_100009893438 [1,1,0,0,0,0|1,0,1]=4 3653 B14R1.422 C=C(F)COCCOc1ccccc1 34a_100000210260_100009893438 [1,1,0,0,0,0|0,0,1]=3 3654 B14R1.422 C=C(F)COCCOc1ccccc1 34a_200010262243_100000184471 [1,1,0,0,0,0|0,0,1]=3 3655 B14R1.422 C=C(F)COCCOc1ccccc1 7a_100000210260_100000042424 [1,1,0,0,0,0|0,0,1]=3 3656 B14R1.422 C=C(F)COCCSc1ccccc1 34a_200010262243_100000246102 [1,1,0,0,0,0|0,1,1]=4 3657 B14R1.422 C=C(F)COCCSc1ccccc1 7a_100000230494_100000042424 [1,1,0,0,0,0|0,1,1]=4 3658 B14R1.422 C=C(F)CSCCOc1ccccc1 62a_100000042424_100000184471 [1,1,0,0,0,0|0,1,1]=4 3659 B14R1.422 C=C(F)CSCCOc1ccccc1 62a_100000184471_100000042424 [1,1,0,0,0,0|0,1,1]=4 3660 B14R1.422 CC(=O)COCCOc1ccccc1 34a_100000211253_100000184471 [1,1,0,0,0,0|0,0,2]=4 3661 B14R1.422 NC(=O)COCCOc1ccccc1 34a_100000210260_100000187820 [1,1,0,0,0,0|1,0,1]=4 3662 B14R1.422 NC(=O)COCCOc1ccccc1 34a_100000210340_100000076697 [1,1,0,0,0,0|1,0,1]=4 3663 B14R1.422 NC(=O)COCCOc1ccccc1 7a_100000210260_100000187820 [1,1,0,0,0,0|1,0,1]=4 3664 B14R1.422 NC(=O)COCCOc1ccccc1 7a_100000210340_100000076697 [1,1,0,0,0,0|1,0,1]=4 3665 B14R1.422 O=C([O-])COCCOc1ccccc1 34a_100000210260_100020667443 [1,1,0,0,0,0|1,0,1]=4 3666 B14R1.520 C=CCC(=O)CCOc1ccccc1 1458a_100000182761_100000210623 [1,1,0,0,0,0|1,0,1]=4 3667 B14R1.520 C=CCC(=O)CCOc1ccccc1 1458a_100000210193_100000184471 [1,1,0,0,0,0|1,0,1]=4 3668 B14R1.520 C=CCN(C)CCOc1ccccc1 2230a_100000184383_100000210623 [1,1,0,0,0,0|1,0,1]=4 3669 B14R1.520 C=CCN(C)CCOc1ccccc1 2230a_100000225617_100000184471 [1,1,0,0,0,0|1,0,1]=4 3670 B14R1.520 C=CCN(C)CCOc1ccccc1 269982a_100000184383_100000210623 [1,1,0,0,0,0|1,0,1]=4 3671 B14R1.520 C=CCN(C)CCOc1ccccc1 269982a_100000225617_100000184471 [1,1,0,0,0,0|1,0,1]=4 3672 B14R1.520 C=CCN(C)CCOc1ccccc1 270004a_100000225617_100000758736 [1,1,0,0,0,0|1,0,1]=4 3673 B14R1.716 C=CC(=O)OCCOc1ccccc1 34a_100000210340_100009813456 [1,1,0,0,0,0|0,0,2]=4 3674 B14R1.716 C=CC(=O)OCCOc1ccccc1 7a_100000210340_100009813456 [1,1,0,0,0,0|0,0,2]=4 3675 B14R1.716 C=CC(C)OCCCc1ccccc1 34a_100000695699_100000211621 [1,1,0,0,0,0|1,0,1]=4 3676 B14R1.716 C=CC(C)OCCOc1ccccc1 34a_100000695699_100000184471 [1,1,0,0,0,0|0,0,1]=3 3677 B14R1.716 C=CC(C)OCCSc1ccccc1 34a_100000695699_100000246102 [1,1,0,0,0,0|0,1,1]=4 3678 B14R1.716 C=CC(C)SCCOc1ccccc1 62a_100011215867_100000184471 [1,1,0,0,0,0|0,1,1]=4 3679 B14R1.882 C=CCCCCOc1ccccc1Br 34a_100000181306_100011215482 [1,1,0,0,0,0|1,0,1]=4 3680 B14R1.882 C=CCCCCOc1ccccc1Br 7a_100000181306_100011215482 [1,1,0,0,0,0|1,0,1]=4 3681 B14R1.882 C=CCCCCOc1ccccc1C 34a_100000210338_100011215482 [1,1,0,0,0,0|1,0,1]=4 3682 B14R1.882 C=CCCCCOc1ccccc1C 7a_100000210338_100011215482 [1,1,0,0,0,0|1,0,1]=4 3683 B14R1.882 C=CCCCCOc1ccccc1Cl 34a_100000210172_100011215482 [1,1,0,0,0,0|1,0,1]=4 3684 B14R1.882 C=CCCCCOc1ccccc1Cl 7a_100000210172_100011215482 [1,1,0,0,0,0|1,0,1]=4 3685 B14R1.882 C=CCCCCOc1ccccc1F 34a_100000210171_100011215482 [1,1,0,0,0,0|1,0,1]=4 3686 B14R1.882 C=CCCCCOc1ccccc1F 7a_100000210171_100011215482 [1,1,0,0,0,0|1,0,1]=4 3687 B14R1.882 C=CCCCCOc1ccccc1I 34a_100000739446_100011215482 [1,1,0,0,0,0|1,0,1]=4 3688 B14R1.882 C=CCCCCOc1ccccc1I 7a_100000739446_100011215482 [1,1,0,0,0,0|1,0,1]=4 3689 B14R1.882 C=CCCCCOc1ccccc1N 34a_100000185747_100011215482 [1,1,0,0,0,0|1,0,1]=4 3690 B14R1.882 C=CCCCCOc1ccccc1N 7a_100000185747_100011215482 [1,1,0,0,0,0|1,0,1]=4 3691 B14R1.882 C=CCNCCOc1ccccc1Br 2230a_100000744007_100000210623 [1,1,0,0,0,0|1,0,1]=4 3692 B14R1.882 C=CCNCCOc1ccccc1Br 2230a_100020586998_100000695877 [1,1,0,0,0,0|1,0,1]=4 3693 B14R1.882 C=CCNCCOc1ccccc1Br 34a_100000744007_100015514636 [1,1,0,0,0,0|1,0,1]=4 3694 B14R1.882 C=CCNCCOc1ccccc1C 2230a_100000743344_100000210623 [1,1,0,0,0,0|1,0,1]=4 3695 B14R1.882 C=CCNCCOc1ccccc1C 2230a_100020586998_100000184434 [1,1,0,0,0,0|1,0,1]=4 3696 B14R1.882 C=CCNCCOc1ccccc1C 34a_100000743344_100015514636 [1,1,0,0,0,0|1,0,1]=4 3697 B14R1.882 C=CCNCCOc1ccccc1Cl 2230a_100000174932_100000210623 [1,1,0,0,0,0|1,0,1]=4 3698 B14R1.882 C=CCNCCOc1ccccc1Cl 34a_100000174932_100015514636 [1,1,0,0,0,0|1,0,1]=4 3699 B14R1.882 C=CCNCCOc1ccccc1F 2230a_100000683764_100000210623 [1,1,0,0,0,0|1,0,1]=4 3700 B14R1.882 C=CCNCCOc1ccccc1F 2230a_100020586998_100000183290 [1,1,0,0,0,0|1,0,1]=4 3701 B14R1.882 C=CCNCCOc1ccccc1F 34a_100000683764_100015514636 [1,1,0,0,0,0|1,0,1]=4 3702 B14R1.882 C=CCOCCCc1ccccc1Br 34a_100000699526_100015514636 [1,1,0,0,0,0|1,0,1]=4 3703 B14R1.882 C=CCOCCCc1ccccc1Br 34a_200000210373_200011713681 [1,1,0,0,0,0|1,0,1]=4 3704 B14R1.882 C=CCOCCCc1ccccc1Br 7a_100000699526_100015514636 [1,1,0,0,0,0|1,0,1]=4 3705 B14R1.882 C=CCOCCCc1ccccc1Cl 34a_100011709251_100015514636 [1,1,0,0,0,0|1,0,1]=4 3706 B14R1.882 C=CCOCCCc1ccccc1Cl 7a_100011709251_100015514636 [1,1,0,0,0,0|1,0,1]=4 3707 B14R1.882 C=CCOCCCc1ccccc1F 34a_100011709249_100015514636 [1,1,0,0,0,0|1,0,1]=4 3708 B14R1.882 C=CCOCCCc1ccccc1F 7a_100011709249_100015514636 [1,1,0,0,0,0|1,0,1]=4 3709 B14R1.882 C=CCOCCNc1ccccc1C 34a_100011233185_100015514636 [1,1,0,0,0,0|1,0,1]=4 3710 B14R1.882 C=CCOCCNc1ccccc1N 34a_100000683943_100015514636 [1,1,0,0,0,0|1,0,1]=4 3711 B14R1.882 C=CCOCCOc1ccccc1Br 34a_100000230753_100015514636 [1,1,0,0,0,0|0,0,1]=3 3712 B14R1.882 C=CCOCCOc1ccccc1Br 34a_200000210373_100000695877 [1,1,0,0,0,0|0,0,1]=3 3713 B14R1.882 C=CCOCCOc1ccccc1Br 7a_100000230753_100015514636 [1,1,0,0,0,0|0,0,1]=3 3714 B14R1.882 C=CCOCCOc1ccccc1C 34a_200000210373_100000184434 [1,1,0,0,0,0|0,0,1]=3 3715 B14R1.882 C=CCOCCOc1ccccc1Cl 34a_200000230518_100015514636 [1,1,0,0,0,0|0,0,1]=3 3716 B14R1.882 C=CCOCCOc1ccccc1Cl 7a_200000230518_100015514636 [1,1,0,0,0,0|0,0,1]=3 3717 B14R1.882 C=CCOCCOc1ccccc1F 34a_100000756447_100015514636 [1,1,0,0,0,0|0,0,1]=3 3718 B14R1.882 C=CCOCCOc1ccccc1F 34a_200000210373_100000183290 [1,1,0,0,0,0|0,0,1]=3 3719 B14R1.882 C=CCOCCOc1ccccc1F 7a_100000756447_100015514636 [1,1,0,0,0,0|0,0,1]=3 3720 B14R1.882 C=CCOCCOc1ccccc1N 34a_100132302172_100015514636 [1,1,0,0,0,0|0,0,1]=3 3721 B14R1.882 C=CCOCCSc1ccccc1Br 34a_200000230852_100015514636 [1,1,0,0,0,0|0,1,1]=4 3722 B14R1.882 C=CCOCCSc1ccccc1Br 7a_200000230852_100015514636 [1,1,0,0,0,0|0,1,1]=4 3723 B14R1.882 C=CCOCCSc1ccccc1Cl 34a_200000230572_100015514636 [1,1,0,0,0,0|0,1,1]=4 3724 B14R1.882 C=CCOCCSc1ccccc1Cl 7a_200000230572_100015514636 [1,1,0,0,0,0|0,1,1]=4 3725 B14R1.882 C=CCOCCSc1ccccc1F 34a_200000230732_100015514636 [1,1,0,0,0,0|0,1,1]=4 3726 B14R1.882 C=CCOCCSc1ccccc1F 7a_200000230732_100015514636 [1,1,0,0,0,0|0,1,1]=4 3727 B14R1.882 C=CCSCCOc1ccccc1Br 62a_100000210623_100000695877 [1,1,0,0,0,0|0,1,1]=4 3728 B14R1.882 C=CCSCCOc1ccccc1Br 62a_100000695877_100000210623 [1,1,0,0,0,0|0,1,1]=4 3729 B14R1.882 C=CCSCCOc1ccccc1C 62a_100000184434_100000210623 [1,1,0,0,0,0|0,1,1]=4 3730 B14R1.882 C=CCSCCOc1ccccc1C 62a_100000210623_100000184434 [1,1,0,0,0,0|0,1,1]=4 3731 B14R1.882 C=CCSCCOc1ccccc1F 62a_100000183290_100000210623 [1,1,0,0,0,0|0,1,1]=4 3732 B14R1.882 C=CCSCCOc1ccccc1F 62a_100000210623_100000183290 [1,1,0,0,0,0|0,1,1]=4 3733 B14R1.882 Nc1ccccc1OCCOCC=O 34a_100132302172_200009817547 [1,1,0,0,0,0|1,0,1]=4 3734 B14R1.882 O=CCOCCOc1ccccc1Br 34a_100000230753_200009817547 [1,1,0,0,0,0|1,0,1]=4 3735 B14R1.882 O=CCOCCOc1ccccc1Br 7a_100000230753_200015260668 [1,1,0,0,0,0|1,0,1]=4 3736 B14R1.882 O=CCOCCOc1ccccc1Cl 34a_200000230518_200009817547 [1,1,0,0,0,0|1,0,1]=4 3737 B14R1.882 O=CCOCCOc1ccccc1Cl 7a_200000230518_200015260668 [1,1,0,0,0,0|1,0,1]=4 3738 B14R1.882 O=CCOCCOc1ccccc1F 34a_100000756447_200009817547 [1,1,0,0,0,0|1,0,1]=4 3739 B14R1.882 O=CCOCCOc1ccccc1F 7a_100000756447_200015260668 [1,1,0,0,0,0|1,0,1]=4 3740 B14R1.29 C=CCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000210623 [1,1,0,0,0,0|1,0,1]=4 3741 B14R1.29 C=CCC(=O)CC(=O)c1ccccc1 1458a_100000210193_100000211460 [1,1,0,0,0,0|1,0,0]=3 3742 B14R1.29 C=CCC(=O)CC(=O)c1ccccn1 1458a_100000210193_100000027445 [1,1,0,0,0,0|2,0,0]=4 3743 B14R1.29 C=CCC(=O)CC(=O)c1cccnc1 1458a_100000210193_100015188593 [1,1,0,0,0,0|2,0,0]=4 3744 B14R1.29 C=CCC(=O)CC(=O)c1ccncc1 1458a_100000210193_100000027454 [1,1,0,0,0,0|2,0,0]=4 3745 B14R1.29 C=CCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210623 [1,1,0,0,0,0|1,0,0]=3 3746 B14R1.29 C=CCC(=O)CC(C)c1ccccc1 1458a_100000210193_100000756946 [1,1,0,0,0,0|1,0,0]=3 3747 B14R1.29 C=CCC(=O)CC(O)c1ccccc1 1458a_100000210193_100000185958 [1,1,0,0,0,0|1,0,0]=3 3748 B14R1.29 C=CCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000210623 [1,1,0,0,0,0|1,0,0]=3 3749 B14R1.29 C=CCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000210623 [1,1,0,0,0,0|1,0,0]=3 3750 B14R1.29 C=CCC(=O)C[C@@H](O)c1ccccc1 1458a_100000210193_100011933945 [1,1,0,0,0,0|1,0,0]=3 3751 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000210193 [1,1,0,0,0,0|2,0,0]=4 3752 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000210193 [1,1,0,0,0,0|2,0,0]=4 3753 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000210193 [1,1,0,0,0,0|2,0,0]=4 3754 B14R1.29 C=CCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000210193 [1,1,0,0,0,0|2,0,0]=4 3755 B14R1.29 C=COC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000036128 [1,1,0,0,0,0|1,0,0]=3 3756 B14R1.29 C=COC(=O)CN(C)c1ccccc1 2230a_100000210012_100000036128 [1,1,0,0,0,0|1,0,0]=3 3757 B14R1.29 C=COC(=O)CN(C)c1ccccc1 269982a_100000210012_100000036128 [1,1,0,0,0,0|1,0,0]=3 3758 B14R1.29 C=COC(=O)CN(C)c1ccccc1 34a_100000210012_100000036128 [1,1,0,0,0,0|1,0,0]=3 3759 B14R1.29 CCOC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000188475 [1,1,0,0,0,0|1,0,1]=4 3760 B14R1.29 CCOC(=O)CN(C)c1ccccc1 2230a_100000210012_100000188475 [1,1,0,0,0,0|1,0,1]=4 3761 B14R1.29 CCOC(=O)CN(C)c1ccccc1 2230a_100000219562_200000210301 [1,1,0,0,0,0|1,0,1]=4 3762 B14R1.29 CCOC(=O)CN(C)c1ccccc1 269982a_100000210012_100000188475 [1,1,0,0,0,0|1,0,1]=4 3763 B14R1.29 CCOC(=O)CN(C)c1ccccc1 269982a_100000219562_200000210301 [1,1,0,0,0,0|1,0,1]=4 3764 B14R1.29 CCOC(=O)CN(C)c1ccccc1 34a_100000210012_100000188475 [1,1,0,0,0,0|1,0,1]=4 3765 B14R1.29 CCOC(=O)CN([13CH3])c1ccccc1 2230a_100000219562_200025704644 [1,1,0,0,0,0|1,0,1]=4 3766 B14R1.29 CCOC(=O)CN([13CH3])c1ccccc1 269982a_100000219562_200025704644 [1,1,0,0,0,0|1,0,1]=4 3767 B14R1.32 C#CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000184674 [1,1,0,0,0,0|0,0,2]=4 3768 B14R1.32 C#CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000184674 [1,1,0,0,0,0|0,0,2]=4 3769 B14R1.32 C#CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000184674 [1,1,0,0,0,0|0,0,2]=4 3770 B14R1.32 C#CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000184674 [1,1,0,0,0,0|0,0,2]=4 3771 B14R1.32 C=CCC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_100000210623 [1,1,0,0,0,0|1,0,1]=4 3772 B14R1.32 C=CCC(=O)C#Cc1cccc(c1)C 1458a_100011892726_100000210623 [1,1,0,0,0,0|1,0,1]=4 3773 B14R1.32 C=CCC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_100000210623 [1,1,0,0,0,0|1,0,1]=4 3774 B14R1.32 C=CCC(=O)C#Cc1cccc(c1)F 1458a_100011892744_100000210623 [1,1,0,0,0,0|1,0,1]=4 3775 B14R1.32 C=CCC(=O)C#Cc1cccc(c1)O 1458a_200009909484_100000210623 [1,1,0,0,0,0|1,0,1]=4 3776 B14R1.32 C=CCC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_100000210623 [1,1,0,0,0,0|1,0,1]=4 3777 B14R1.32 C=CCC(=O)C=Cc1cccc(c1)C 1458a_100000690095_100000210623 [1,1,0,0,0,0|1,0,1]=4 3778 B14R1.32 C=CCC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_100000210623 [1,1,0,0,0,0|1,0,1]=4 3779 B14R1.32 C=CCC(=O)C=Cc1cccc(c1)F 1458a_100000718793_100000210623 [1,1,0,0,0,0|1,0,1]=4 3780 B14R1.32 C=CCC(=O)C=Cc1cccc(c1)I 1458a_100020647043_100000210623 [1,1,0,0,0,0|1,0,1]=4 3781 B14R1.32 C=CCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000210623 [1,1,0,0,0,0|1,0,0]=3 3782 B14R1.32 C=CCC(=O)CCc1cccc(c1)Br 1458a_100000210193_100011740638 [1,1,0,0,0,0|1,0,0]=3 3783 B14R1.32 C=CCC(=O)CCc1cccc(c1)C 1458a_100000210193_100011713685 [1,1,0,0,0,0|1,0,0]=3 3784 B14R1.32 C=CCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000210623 [1,1,0,0,0,0|1,0,0]=3 3785 B14R1.32 C=CCC(=O)CCc1cccc(c1)Cl 1458a_100000210193_100011713710 [1,1,0,0,0,0|1,0,0]=3 3786 B14R1.32 C=CCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000210623 [1,1,0,0,0,0|1,0,0]=3 3787 B14R1.32 C=CCC(=O)CCc1cccc(c1)F 1458a_100000210193_100011217235 [1,1,0,0,0,0|1,0,0]=3 3788 B14R1.32 C=CCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000210623 [1,1,0,0,0,0|1,0,0]=3 3789 B14R1.32 C=CCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000210623 [1,1,0,0,0,0|1,0,0]=3 3790 B14R1.32 C=CCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000210623 [1,1,0,0,0,0|1,0,0]=3 3791 B14R1.32 C=CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210623 [1,1,0,0,0,0|0,0,0]=2 3792 B14R1.32 C=CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210623 [1,1,0,0,0,0|0,0,0]=2 3793 B14R1.32 C=CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210623 [1,1,0,0,0,0|0,0,0]=2 3794 B14R1.32 C=CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210623 [1,1,0,0,0,0|0,0,0]=2 3795 B14R1.32 C=CCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000210623 [1,1,0,0,0,0|0,1,0]=3 3796 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000210193 [1,1,0,0,0,0|2,0,0]=4 3797 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000210193 [1,1,0,0,0,0|2,0,0]=4 3798 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000210193 [1,1,0,0,0,0|2,0,0]=4 3799 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000210193 [1,1,0,0,0,0|2,0,0]=4 3800 B14R1.32 C=CCC(=O)NCc1cccc(c1)C 11a_100000185548_100000210193 [1,1,0,0,0,0|2,0,0]=4 3801 B14R1.32 C=CCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000210193 [1,1,0,0,0,0|2,0,0]=4 3802 B14R1.32 C=CCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000210193 [1,1,0,0,0,0|2,0,0]=4 3803 B14R1.32 C=CCC(=O)NCc1cccc(c1)C 527a_100000185548_100000210193 [1,1,0,0,0,0|2,0,0]=4 3804 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000210193 [1,1,0,0,0,0|2,0,0]=4 3805 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000210193 [1,1,0,0,0,0|2,0,0]=4 3806 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000210193 [1,1,0,0,0,0|2,0,0]=4 3807 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000210193 [1,1,0,0,0,0|2,0,0]=4 3808 B14R1.32 C=CCC(=O)NCc1cccc(c1)F 11a_100000174948_100000210193 [1,1,0,0,0,0|2,0,0]=4 3809 B14R1.32 C=CCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000210193 [1,1,0,0,0,0|2,0,0]=4 3810 B14R1.32 C=CCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000210193 [1,1,0,0,0,0|2,0,0]=4 3811 B14R1.32 C=CCC(=O)NCc1cccc(c1)F 527a_100000174948_100000210193 [1,1,0,0,0,0|2,0,0]=4 3812 B14R1.32 C=CCC(=O)NCc1cccc(c1)I 11a_100000106179_100000210193 [1,1,0,0,0,0|2,0,0]=4 3813 B14R1.32 C=CCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000210193 [1,1,0,0,0,0|2,0,0]=4 3814 B14R1.32 C=CCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000210193 [1,1,0,0,0,0|2,0,0]=4 3815 B14R1.32 C=CCC(=O)NCc1cccc(c1)I 527a_100000106179_100000210193 [1,1,0,0,0,0|2,0,0]=4 3816 B14R1.32 C=CCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210193 [1,1,0,0,0,0|2,0,0]=4 3817 B14R1.32 C=CCC(=O)NCc1cccc(c1)O 527a_100000743036_100000210193 [1,1,0,0,0,0|2,0,0]=4 3818 B14R1.32 C=CCC(=O)NNc1cccc(c1)Br 22a_100000217339_100000210193 [1,1,0,0,0,0|2,0,0]=4 3819 B14R1.32 C=CCC(=O)NNc1cccc(c1)C 22a_100000681630_100000210193 [1,1,0,0,0,0|2,0,0]=4 3820 B14R1.32 C=CCC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000210193 [1,1,0,0,0,0|2,0,0]=4 3821 B14R1.32 C=CCC(=O)NNc1cccc(c1)F 22a_100000745080_100000210193 [1,1,0,0,0,0|2,0,0]=4 3822 B14R1.32 C=CCC(=O)NNc1cccc(c1)I 22a_100020605690_100000210193 [1,1,0,0,0,0|2,0,0]=4 3823 B14R1.32 C=COC(=O)CNc1cccc(c1)Br 34a_100000210019_100000036128 [1,1,0,0,0,0|1,0,0]=3 3824 B14R1.32 C=COC(=O)CNc1cccc(c1)C 2230a_100000188690_100000036128 [1,1,0,0,0,0|1,0,0]=3 3825 B14R1.32 C=COC(=O)CNc1cccc(c1)C 34a_100000188690_100000036128 [1,1,0,0,0,0|1,0,0]=3 3826 B14R1.32 C=COC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000036128 [1,1,0,0,0,0|1,0,0]=3 3827 B14R1.32 C=COC(=O)CNc1cccc(c1)F 34a_100000210047_100000036128 [1,1,0,0,0,0|1,0,0]=3 3828 B14R1.32 C=COC(=O)CNc1cccc(c1)I 34a_100000211102_100000036128 [1,1,0,0,0,0|1,0,0]=3 3829 B14R1.32 C=COC(=O)CNc1cccc(c1)O 34a_100000210217_100000036128 [1,1,0,0,0,0|1,0,0]=3 3830 B14R1.32 C=COC(=O)COc1cc(cnn1)C 34a_100000766097_100000036128 [1,1,0,0,0,0|2,0,0]=4 3831 B14R1.32 C=COC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000036128 [1,1,0,0,0,0|1,0,0]=3 3832 B14R1.32 C=COC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000036128 [1,1,0,0,0,0|1,0,0]=3 3833 B14R1.32 C=COC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000036128 [1,1,0,0,0,0|1,0,0]=3 3834 B14R1.32 C=COC(=O)COc1cccc(c1)Br 34a_100000210342_100000036128 [1,1,0,0,0,0|0,0,0]=2 3835 B14R1.32 C=COC(=O)COc1cccc(c1)C 34a_100000210337_100000036128 [1,1,0,0,0,0|0,0,0]=2 3836 B14R1.32 C=COC(=O)COc1cccc(c1)Cl 34a_100000210295_100000036128 [1,1,0,0,0,0|0,0,0]=2 3837 B14R1.32 C=COC(=O)COc1cccc(c1)F 34a_100000210426_100000036128 [1,1,0,0,0,0|0,0,0]=2 3838 B14R1.32 C=COC(=O)COc1cccc(c1)I 34a_100000211634_100000036128 [1,1,0,0,0,0|0,0,0]=2 3839 B14R1.32 C=COC(=O)COc1cccc(c1)N 34a_100000210217_100000036128 [1,1,0,0,0,0|0,0,0]=2 3840 B14R1.32 C=COC(=O)COc1cccc(n1)F 34a_100011432558_100000036128 [1,1,0,0,0,0|1,0,0]=3 3841 B14R1.32 C=COC(=O)COc1ccnc(c1)C 34a_100000688365_100000036128 [1,1,0,0,0,0|1,0,0]=3 3842 B14R1.32 C=COC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000036128 [1,1,0,0,0,0|1,0,0]=3 3843 B14R1.32 C=COC(=O)COc1ccnc(c1)F 34a_100000732698_100000036128 [1,1,0,0,0,0|1,0,0]=3 3844 B14R1.32 C=COC(=O)COc1ccnc(c1)N 34a_100011834064_100000036128 [1,1,0,0,0,0|1,0,0]=3 3845 B14R1.32 C=COC(=O)COc1cncc(c1)Br 34a_100000754920_100000036128 [1,1,0,0,0,0|1,0,0]=3 3846 B14R1.32 C=COC(=O)COc1cncc(c1)C 34a_100011830280_100000036128 [1,1,0,0,0,0|1,0,0]=3 3847 B14R1.32 C=COC(=O)COc1cncc(c1)F 34a_100011830296_100000036128 [1,1,0,0,0,0|1,0,0]=3 3848 B14R1.32 C=COC(=O)COc1cncc(c1)N 34a_100011997051_100000036128 [1,1,0,0,0,0|1,0,0]=3 3849 B14R1.32 C=COC(=O)COc1cnnc(c1)Cl 34a_200010734679_100000036128 [1,1,0,0,0,0|2,0,0]=4 3850 B14R1.32 C=COC(=O)COc1cnnc(c1)N 34a_200015193112_100000036128 [1,1,0,0,0,0|2,0,0]=4 3851 B14R1.32 C=COC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000036128 [1,1,0,0,0,0|1,1,0]=4 3852 B14R1.32 C=COC(=O)CSc1cc(ccn1)C 62a_100000036128_100000750283 [1,1,0,0,0,0|1,1,0]=4 3853 B14R1.32 C=COC(=O)CSc1cc(ccn1)C 62a_100000750283_100000036128 [1,1,0,0,0,0|1,1,0]=4 3854 B14R1.32 C=COC(=O)CSc1cc(ccn1)Cl 62a_100000036128_100010167805 [1,1,0,0,0,0|1,1,0]=4 3855 B14R1.32 C=COC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000036128 [1,1,0,0,0,0|1,1,0]=4 3856 B14R1.32 C=COC(=O)CSc1cc(ccn1)F 62a_100000036128_100000764206 [1,1,0,0,0,0|1,1,0]=4 3857 B14R1.32 C=COC(=O)CSc1cc(ccn1)F 62a_100000764206_100000036128 [1,1,0,0,0,0|1,1,0]=4 3858 B14R1.32 C=COC(=O)CSc1cc(ccn1)N 62a_100000036128_100009814236 [1,1,0,0,0,0|1,1,0]=4 3859 B14R1.32 C=COC(=O)CSc1cc(ccn1)N 62a_100009814236_100000036128 [1,1,0,0,0,0|1,1,0]=4 3860 B14R1.32 C=COC(=O)CSc1cc(ccn1)O 62a_100000036128_100000762945 [1,1,0,0,0,0|1,1,0]=4 3861 B14R1.32 C=COC(=O)CSc1cc[nH]c(=O)c1 62a_100000036128_100009816521 [1,1,0,0,0,0|1,1,0]=4 3862 B14R1.32 C=COC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000036128 [1,1,0,0,0,0|1,1,0]=4 3863 B14R1.32 C=COC(=O)CSc1ccc[n+](c1)C 62a_100000036128_100009996589 [1,1,0,0,0,0|1,1,0]=4 3864 B14R1.32 C=COC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000036128 [1,1,0,0,0,0|1,1,0]=4 3865 B14R1.32 C=COC(=O)CSc1ccc[n+](c1)[O-] 62a_100000036128_100009815978 [1,1,0,0,0,0|1,1,0]=4 3866 B14R1.32 C=COC(=O)CSc1cccc(=O)[nH]1 62a_100000036128_100000752884 [1,1,0,0,0,0|1,1,0]=4 3867 B14R1.32 C=COC(=O)CSc1cccc(c1)Br 62a_100000036128_100000691529 [1,1,0,0,0,0|0,1,0]=3 3868 B14R1.32 C=COC(=O)CSc1cccc(c1)Br 62a_100000691529_100000036128 [1,1,0,0,0,0|0,1,0]=3 3869 B14R1.32 C=COC(=O)CSc1cccc(c1)C 62a_100000036128_100011215228 [1,1,0,0,0,0|0,1,0]=3 3870 B14R1.32 C=COC(=O)CSc1cccc(c1)C 62a_100011215228_100000036128 [1,1,0,0,0,0|0,1,0]=3 3871 B14R1.32 C=COC(=O)CSc1cccc(c1)Cl 62a_100000036128_100000699651 [1,1,0,0,0,0|0,1,0]=3 3872 B14R1.32 C=COC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000036128 [1,1,0,0,0,0|0,1,0]=3 3873 B14R1.32 C=COC(=O)CSc1cccc(c1)F 62a_100000036128_100000685547 [1,1,0,0,0,0|0,1,0]=3 3874 B14R1.32 C=COC(=O)CSc1cccc(c1)F 62a_100000685547_100000036128 [1,1,0,0,0,0|0,1,0]=3 3875 B14R1.32 C=COC(=O)CSc1cccc(c1)N 62a_100000036128_100000210019 [1,1,0,0,0,0|0,1,0]=3 3876 B14R1.32 C=COC(=O)CSc1cccc(c1)N 62a_100000210019_100000036128 [1,1,0,0,0,0|0,1,0]=3 3877 B14R1.32 C=COC(=O)CSc1cccc(c1)O 62a_100000036128_100000211634 [1,1,0,0,0,0|0,1,0]=3 3878 B14R1.32 C=COC(=O)CSc1cccc(c1)[S] 62a_100000036128_114929384022 [1,1,0,0,0,0|0,1,0]=3 3879 B14R1.32 C=COC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000036128 [1,1,0,0,0,0|0,1,0]=3 3880 B14R1.32 C=COC(=O)CSc1cccc(n1)Br 62a_100000036128_100000684672 [1,1,0,0,0,0|1,1,0]=4 3881 B14R1.32 C=COC(=O)CSc1cccc(n1)Br 62a_100000684672_100000036128 [1,1,0,0,0,0|1,1,0]=4 3882 B14R1.32 C=COC(=O)CSc1cccc(n1)C 62a_100000036128_100000742759 [1,1,0,0,0,0|1,1,0]=4 3883 B14R1.32 C=COC(=O)CSc1cccc(n1)C 62a_100000742759_100000036128 [1,1,0,0,0,0|1,1,0]=4 3884 B14R1.32 C=COC(=O)CSc1cccc(n1)Cl 62a_100000036128_100000051397 [1,1,0,0,0,0|1,1,0]=4 3885 B14R1.32 C=COC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000036128 [1,1,0,0,0,0|1,1,0]=4 3886 B14R1.32 C=COC(=O)CSc1cccc(n1)F 62a_100000036128_100009815982 [1,1,0,0,0,0|1,1,0]=4 3887 B14R1.32 C=COC(=O)CSc1cccc(n1)F 62a_100009815982_100000036128 [1,1,0,0,0,0|1,1,0]=4 3888 B14R1.32 C=COC(=O)CSc1cccc(n1)N 62a_100000036128_100000740741 [1,1,0,0,0,0|1,1,0]=4 3889 B14R1.32 C=COC(=O)CSc1cccc(n1)N 62a_100000740741_100000036128 [1,1,0,0,0,0|1,1,0]=4 3890 B14R1.32 C=COC(=O)CSc1ccnc(c1)Br 62a_100000036128_100009814637 [1,1,0,0,0,0|1,1,0]=4 3891 B14R1.32 C=COC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000036128 [1,1,0,0,0,0|1,1,0]=4 3892 B14R1.32 C=COC(=O)CSc1ccnc(c1)C 62a_100000036128_100000758586 [1,1,0,0,0,0|1,1,0]=4 3893 B14R1.32 C=COC(=O)CSc1ccnc(c1)C 62a_100000758586_100000036128 [1,1,0,0,0,0|1,1,0]=4 3894 B14R1.32 C=COC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000036128 [1,1,0,0,0,0|1,1,0]=4 3895 B14R1.32 C=COC(=O)CSc1ccnc(c1)Cl 62a_100000036128_100000035001 [1,1,0,0,0,0|1,1,0]=4 3896 B14R1.32 C=COC(=O)CSc1ccnc(c1)F 62a_100000036128_100009816116 [1,1,0,0,0,0|1,1,0]=4 3897 B14R1.32 C=COC(=O)CSc1ccnc(c1)F 62a_100009816116_100000036128 [1,1,0,0,0,0|1,1,0]=4 3898 B14R1.32 C=COC(=O)CSc1ccnc(c1)N 62a_100000036128_100000049665 [1,1,0,0,0,0|1,1,0]=4 3899 B14R1.32 C=COC(=O)CSc1ccnc(c1)N 62a_100000049665_100000036128 [1,1,0,0,0,0|1,1,0]=4 3900 B14R1.32 C=COC(=O)CSc1cncc(c1)Br 62a_100000036128_100000728054 [1,1,0,0,0,0|1,1,0]=4 3901 B14R1.32 C=COC(=O)CSc1cncc(c1)Br 62a_100000728054_100000036128 [1,1,0,0,0,0|1,1,0]=4 3902 B14R1.32 C=COC(=O)CSc1cncc(c1)C 62a_100000036128_100000760492 [1,1,0,0,0,0|1,1,0]=4 3903 B14R1.32 C=COC(=O)CSc1cncc(c1)C 62a_100000760492_100000036128 [1,1,0,0,0,0|1,1,0]=4 3904 B14R1.32 C=COC(=O)CSc1cncc(c1)Cl 62a_100000036128_100000049639 [1,1,0,0,0,0|1,1,0]=4 3905 B14R1.32 C=COC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000036128 [1,1,0,0,0,0|1,1,0]=4 3906 B14R1.32 C=COC(=O)CSc1cncc(c1)F 62a_100000036128_100000744099 [1,1,0,0,0,0|1,1,0]=4 3907 B14R1.32 C=COC(=O)CSc1cncc(c1)F 62a_100000744099_100000036128 [1,1,0,0,0,0|1,1,0]=4 3908 B14R1.32 C=COC(=O)CSc1cncc(c1)N 62a_100000036128_100000687067 [1,1,0,0,0,0|1,1,0]=4 3909 B14R1.32 C=COC(=O)CSc1cncc(c1)N 62a_100000687067_100000036128 [1,1,0,0,0,0|1,1,0]=4 3910 B14R1.32 C=COC(=O)CSc1cncc(c1)O 62a_100000036128_100000754920 [1,1,0,0,0,0|1,1,0]=4 3911 B14R1.32 C=COC(=O)CSc1cncc(c1)O 62a_100000754920_100000036128 [1,1,0,0,0,0|1,1,0]=4 3912 B14R1.32 CCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210303 [1,1,0,0,0,0|0,0,2]=4 3913 B14R1.32 CCCC(=O)COc1cccc(c1)Br 7a_100000210342_100000747444 [1,1,0,0,0,0|0,0,2]=4 3914 B14R1.32 CCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210303 [1,1,0,0,0,0|0,0,2]=4 3915 B14R1.32 CCCC(=O)COc1cccc(c1)C 7a_100000210337_100000747444 [1,1,0,0,0,0|0,0,2]=4 3916 B14R1.32 CCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210303 [1,1,0,0,0,0|0,0,2]=4 3917 B14R1.32 CCCC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747444 [1,1,0,0,0,0|0,0,2]=4 3918 B14R1.32 CCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210303 [1,1,0,0,0,0|0,0,2]=4 3919 B14R1.32 CCCC(=O)COc1cccc(c1)F 7a_100000210426_100000747444 [1,1,0,0,0,0|0,0,2]=4 3920 B14R1.32 CCCC(=O)COc1cccc(c1)I 7a_100000211634_100000747444 [1,1,0,0,0,0|0,0,2]=4 3921 B14R1.32 CCNC(=O)COc1cccc(c1)Br 11a_100015525214_100000182359 [1,1,0,0,0,0|1,0,1]=4 3922 B14R1.32 CCNC(=O)COc1cccc(c1)Br 240690a_100015525214_100000182359 [1,1,0,0,0,0|1,0,1]=4 3923 B14R1.32 CCNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183381 [1,1,0,0,0,0|1,0,1]=4 3924 B14R1.32 CCNC(=O)COc1cccc(c1)Br 527a_100015525214_100000182359 [1,1,0,0,0,0|1,0,1]=4 3925 B14R1.32 CCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183381 [1,1,0,0,0,0|1,0,1]=4 3926 B14R1.32 CCNC(=O)COc1cccc(c1)C 11a_100015525214_100000183606 [1,1,0,0,0,0|1,0,1]=4 3927 B14R1.32 CCNC(=O)COc1cccc(c1)C 240690a_100015525214_100000183606 [1,1,0,0,0,0|1,0,1]=4 3928 B14R1.32 CCNC(=O)COc1cccc(c1)C 34a_100000210337_100000183381 [1,1,0,0,0,0|1,0,1]=4 3929 B14R1.32 CCNC(=O)COc1cccc(c1)C 527a_100015525214_100000183606 [1,1,0,0,0,0|1,0,1]=4 3930 B14R1.32 CCNC(=O)COc1cccc(c1)C 7a_100000210337_100000183381 [1,1,0,0,0,0|1,0,1]=4 3931 B14R1.32 CCNC(=O)COc1cccc(c1)Cl 11a_100015525214_100000184978 [1,1,0,0,0,0|1,0,1]=4 3932 B14R1.32 CCNC(=O)COc1cccc(c1)Cl 240690a_100015525214_100000184978 [1,1,0,0,0,0|1,0,1]=4 3933 B14R1.32 CCNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183381 [1,1,0,0,0,0|1,0,1]=4 3934 B14R1.32 CCNC(=O)COc1cccc(c1)Cl 527a_100015525214_100000184978 [1,1,0,0,0,0|1,0,1]=4 3935 B14R1.32 CCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183381 [1,1,0,0,0,0|1,0,1]=4 3936 B14R1.32 CCNC(=O)COc1cccc(c1)F 11a_100015525214_100000182781 [1,1,0,0,0,0|1,0,1]=4 3937 B14R1.32 CCNC(=O)COc1cccc(c1)F 240690a_100015525214_100000182781 [1,1,0,0,0,0|1,0,1]=4 3938 B14R1.32 CCNC(=O)COc1cccc(c1)F 34a_100000210426_100000183381 [1,1,0,0,0,0|1,0,1]=4 3939 B14R1.32 CCNC(=O)COc1cccc(c1)F 527a_100015525214_100000182781 [1,1,0,0,0,0|1,0,1]=4 3940 B14R1.32 CCNC(=O)COc1cccc(c1)F 7a_100000210426_100000183381 [1,1,0,0,0,0|1,0,1]=4 3941 B14R1.32 CCNC(=O)COc1cccc(c1)I 34a_100000211634_100000183381 [1,1,0,0,0,0|1,0,1]=4 3942 B14R1.32 CCNC(=O)COc1cccc(c1)I 7a_100000211634_100000183381 [1,1,0,0,0,0|1,0,1]=4 3943 B14R1.32 CCNC(=O)COc1cccc(c1)N 34a_100000210217_100000183381 [1,1,0,0,0,0|1,0,1]=4 3944 B14R1.32 CCOC(=O)CCc1cccc(c1)O 271570a_203496583355_200000172381 [1,1,0,0,0,0|1,0,1]=4 3945 B14R1.32 CCOC(=O)CNc1cccc(c1)Br 34a_100000210019_100000188475 [1,1,0,0,0,0|1,0,1]=4 3946 B14R1.32 CCOC(=O)CNc1cccc(c1)C 2230a_100000188690_100000188475 [1,1,0,0,0,0|1,0,1]=4 3947 B14R1.32 CCOC(=O)CNc1cccc(c1)C 34a_100000188690_100000188475 [1,1,0,0,0,0|1,0,1]=4 3948 B14R1.32 CCOC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000188475 [1,1,0,0,0,0|1,0,1]=4 3949 B14R1.32 CCOC(=O)CNc1cccc(c1)F 34a_100000210047_100000188475 [1,1,0,0,0,0|1,0,1]=4 3950 B14R1.32 CCOC(=O)CNc1cccc(c1)I 34a_100000211102_100000188475 [1,1,0,0,0,0|1,0,1]=4 3951 B14R1.32 CCOC(=O)CNc1cccc(c1)O 271570a_203496583355_200000219647 [1,1,0,0,0,0|1,0,1]=4 3952 B14R1.32 CCOC(=O)CNc1cccc(c1)O 34a_100000210217_100000188475 [1,1,0,0,0,0|1,0,1]=4 3953 B14R1.32 CCOC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000188475 [1,1,0,0,0,0|1,0,1]=4 3954 B14R1.32 CCOC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000188475 [1,1,0,0,0,0|1,0,1]=4 3955 B14R1.32 CCOC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000188475 [1,1,0,0,0,0|1,0,1]=4 3956 B14R1.32 CCOC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000188475 [1,1,0,0,0,0|1,0,1]=4 3957 B14R1.32 CCOC(=O)COc1cccc(c1)Br 34a_100000210342_100000188475 [1,1,0,0,0,0|0,0,1]=3 3958 B14R1.32 CCOC(=O)COc1cccc(c1)Br 7a_100000210342_100000188475 [1,1,0,0,0,0|0,0,1]=3 3959 B14R1.32 CCOC(=O)COc1cccc(c1)C 34a_100000210337_100000188475 [1,1,0,0,0,0|0,0,1]=3 3960 B14R1.32 CCOC(=O)COc1cccc(c1)C 7a_100000210337_100000188475 [1,1,0,0,0,0|0,0,1]=3 3961 B14R1.32 CCOC(=O)COc1cccc(c1)Cl 34a_100000210295_100000188475 [1,1,0,0,0,0|0,0,1]=3 3962 B14R1.32 CCOC(=O)COc1cccc(c1)Cl 7a_100000210295_100000188475 [1,1,0,0,0,0|0,0,1]=3 3963 B14R1.32 CCOC(=O)COc1cccc(c1)F 34a_100000210426_100000188475 [1,1,0,0,0,0|0,0,1]=3 3964 B14R1.32 CCOC(=O)COc1cccc(c1)F 7a_100000210426_100000188475 [1,1,0,0,0,0|0,0,1]=3 3965 B14R1.32 CCOC(=O)COc1cccc(c1)I 34a_100000211634_100000188475 [1,1,0,0,0,0|0,0,1]=3 3966 B14R1.32 CCOC(=O)COc1cccc(c1)I 7a_100000211634_100000188475 [1,1,0,0,0,0|0,0,1]=3 3967 B14R1.32 CCOC(=O)COc1cccc(c1)N 34a_100000210217_100000188475 [1,1,0,0,0,0|0,0,1]=3 3968 B14R1.32 CCOC(=O)COc1cccc(c1)O 271570a_203496583355_100000170171 [1,1,0,0,0,0|0,0,1]=3 3969 B14R1.32 CCOC(=O)COc1cccc(n1)F 34a_100011432558_100000188475 [1,1,0,0,0,0|1,0,1]=4 3970 B14R1.32 CCOC(=O)COc1ccnc(c1)C 34a_100000688365_100000188475 [1,1,0,0,0,0|1,0,1]=4 3971 B14R1.32 CCOC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000188475 [1,1,0,0,0,0|1,0,1]=4 3972 B14R1.32 CCOC(=O)COc1ccnc(c1)F 34a_100000732698_100000188475 [1,1,0,0,0,0|1,0,1]=4 3973 B14R1.32 CCOC(=O)COc1ccnc(c1)N 34a_100011834064_100000188475 [1,1,0,0,0,0|1,0,1]=4 3974 B14R1.32 CCOC(=O)COc1cncc(c1)Br 34a_100000754920_100000188475 [1,1,0,0,0,0|1,0,1]=4 3975 B14R1.32 CCOC(=O)COc1cncc(c1)Br 7a_100000754920_100000188475 [1,1,0,0,0,0|1,0,1]=4 3976 B14R1.32 CCOC(=O)COc1cncc(c1)C 34a_100011830280_100000188475 [1,1,0,0,0,0|1,0,1]=4 3977 B14R1.32 CCOC(=O)COc1cncc(c1)C 7a_100011830280_100000188475 [1,1,0,0,0,0|1,0,1]=4 3978 B14R1.32 CCOC(=O)COc1cncc(c1)Cl 7a_100000032511_100000188475 [1,1,0,0,0,0|1,0,1]=4 3979 B14R1.32 CCOC(=O)COc1cncc(c1)F 34a_100011830296_100000188475 [1,1,0,0,0,0|1,0,1]=4 3980 B14R1.32 CCOC(=O)COc1cncc(c1)F 7a_100011830296_100000188475 [1,1,0,0,0,0|1,0,1]=4 3981 B14R1.32 CCOC(=O)COc1cncc(c1)N 34a_100011997051_100000188475 [1,1,0,0,0,0|1,0,1]=4 3982 B14R1.32 CCOC(=O)CSc1cccc(c1)Br 62a_100000188475_100000691529 [1,1,0,0,0,0|0,1,1]=4 3983 B14R1.32 CCOC(=O)CSc1cccc(c1)Br 62a_100000691529_100000188475 [1,1,0,0,0,0|0,1,1]=4 3984 B14R1.32 CCOC(=O)CSc1cccc(c1)C 62a_100000188475_100011215228 [1,1,0,0,0,0|0,1,1]=4 3985 B14R1.32 CCOC(=O)CSc1cccc(c1)C 62a_100011215228_100000188475 [1,1,0,0,0,0|0,1,1]=4 3986 B14R1.32 CCOC(=O)CSc1cccc(c1)Cl 62a_100000188475_100000699651 [1,1,0,0,0,0|0,1,1]=4 3987 B14R1.32 CCOC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000188475 [1,1,0,0,0,0|0,1,1]=4 3988 B14R1.32 CCOC(=O)CSc1cccc(c1)F 62a_100000188475_100000685547 [1,1,0,0,0,0|0,1,1]=4 3989 B14R1.32 CCOC(=O)CSc1cccc(c1)F 62a_100000685547_100000188475 [1,1,0,0,0,0|0,1,1]=4 3990 B14R1.32 CCOC(=O)CSc1cccc(c1)N 62a_100000188475_100000210019 [1,1,0,0,0,0|0,1,1]=4 3991 B14R1.32 CCOC(=O)CSc1cccc(c1)N 62a_100000210019_100000188475 [1,1,0,0,0,0|0,1,1]=4 3992 B14R1.32 CCOC(=O)CSc1cccc(c1)O 62a_100000188475_100000211634 [1,1,0,0,0,0|0,1,1]=4 3993 B14R1.32 CCOC(=O)CSc1cccc(c1)[S] 62a_100000188475_114929384022 [1,1,0,0,0,0|0,1,1]=4 3994 B14R1.32 CCOC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000188475 [1,1,0,0,0,0|0,1,1]=4 3995 B14R1.32 Cc1cccc(c1)OCC(=O)CC#N 1458a_100000183606_100011214920 [1,1,0,0,0,0|1,0,1]=4 3996 B14R1.32 Cc1cccc(c1)OCC(=O)CCF 1458a_100000183606_100011217306 [1,1,0,0,0,0|1,0,1]=4 3997 B14R1.32 Cc1cccc(c1)OCC(=O)CCO 1458a_100000183606_100000211926 [1,1,0,0,0,0|1,0,1]=4 3998 B14R1.32 Cc1cccc(c1)OCC(=O)NCO 34a_100000210337_100000185155 [1,1,0,0,0,0|2,0,0]=4 3999 B14R1.32 Cc1cccc(c1)OCC(=O)NCO 7a_100000210337_100000185155 [1,1,0,0,0,0|2,0,0]=4 4000 B14R1.32 N#CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100011214920 [1,1,0,0,0,0|1,0,1]=4 4001 B14R1.32 N#CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100011214920 [1,1,0,0,0,0|1,0,1]=4 4002 B14R1.32 N#CCC(=O)COc1cccc(c1)F 1458a_100000182781_100011214920 [1,1,0,0,0,0|1,0,1]=4 4003 B14R1.32 Nc1cccc(c1)OCC(=O)NCO 34a_100000210217_100000185155 [1,1,0,0,0,0|2,0,0]=4 4004 B14R1.32 O=C(CCF)COc1cccc(c1)Br 1458a_100000182359_100011217306 [1,1,0,0,0,0|1,0,1]=4 4005 B14R1.32 O=C(CCF)COc1cccc(c1)Cl 1458a_100000184978_100011217306 [1,1,0,0,0,0|1,0,1]=4 4006 B14R1.32 O=C(CCF)COc1cccc(c1)F 1458a_100000182781_100011217306 [1,1,0,0,0,0|1,0,1]=4 4007 B14R1.32 O=C(CCO)COc1cccc(c1)Br 1458a_100000182359_100000211926 [1,1,0,0,0,0|1,0,1]=4 4008 B14R1.32 O=C(CCO)COc1cccc(c1)Cl 1458a_100000184978_100000211926 [1,1,0,0,0,0|1,0,1]=4 4009 B14R1.32 O=C(CCO)COc1cccc(c1)F 1458a_100000182781_100000211926 [1,1,0,0,0,0|1,0,1]=4 4010 B14R1.32 O=C(COc1cccc(c1)Br)NCO 34a_100000210342_100000185155 [1,1,0,0,0,0|2,0,0]=4 4011 B14R1.32 O=C(COc1cccc(c1)Br)NCO 7a_100000210342_100000185155 [1,1,0,0,0,0|2,0,0]=4 4012 B14R1.32 O=C(COc1cccc(c1)Cl)NCO 34a_100000210295_100000185155 [1,1,0,0,0,0|2,0,0]=4 4013 B14R1.32 O=C(COc1cccc(c1)Cl)NCO 7a_100000210295_100000185155 [1,1,0,0,0,0|2,0,0]=4 4014 B14R1.32 O=C(COc1cccc(c1)F)NCO 34a_100000210426_100000185155 [1,1,0,0,0,0|2,0,0]=4 4015 B14R1.32 O=C(COc1cccc(c1)F)NCO 7a_100000210426_100000185155 [1,1,0,0,0,0|2,0,0]=4 4016 B14R1.32 O=C(COc1cccc(c1)I)NCO 34a_100000211634_100000185155 [1,1,0,0,0,0|2,0,0]=4 4017 B14R1.32 O=C(COc1cccc(c1)I)NCO 7a_100000211634_100000185155 [1,1,0,0,0,0|2,0,0]=4 4018 B14R1.60 C#CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000184674 [1,1,0,0,0,0|0,0,2]=4 4019 B14R1.60 C=CCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210623 [1,1,0,0,0,0|1,0,1]=4 4020 B14R1.60 C=CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210623 [1,1,0,0,0,0|1,0,1]=4 4021 B14R1.60 C=CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210623 [1,1,0,0,0,0|1,0,1]=4 4022 B14R1.60 C=CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210623 [1,1,0,0,0,0|1,0,1]=4 4023 B14R1.60 C=CCC(=O)C(C)Cc1ccccc1 1458a_100000210193_200011218536 [1,1,0,0,0,0|1,0,0]=3 4024 B14R1.60 C=CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210623 [1,1,0,0,0,0|1,0,0]=3 4025 B14R1.60 C=CCC(=O)C(C)Cc1ccccn1 1458a_100012000792_100000210623 [1,1,0,0,0,0|2,0,0]=4 4026 B14R1.60 C=CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210623 [1,1,0,0,0,0|0,0,0]=2 4027 B14R1.60 C=CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210623 [1,1,0,0,0,0|0,1,0]=3 4028 B14R1.60 C=CCC(=O)C(C)Sc1ccccn1 1458a_100000156770_100000210623 [1,1,0,0,0,0|1,1,0]=4 4029 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210193 [1,1,0,0,0,0|2,0,0]=4 4030 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210193 [1,1,0,0,0,0|2,0,0]=4 4031 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210193 [1,1,0,0,0,0|2,0,0]=4 4032 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210193 [1,1,0,0,0,0|2,0,0]=4 4033 B14R1.60 C=CCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210623 [1,1,0,0,0,0|1,0,0]=3 4034 B14R1.60 CC(Oc1ccccc1)C(=O)CC#N 1458a_100000188414_100011214920 [1,1,0,0,0,0|1,0,1]=4 4035 B14R1.60 CC(Oc1ccccc1)C(=O)CCF 1458a_100000188414_100011217306 [1,1,0,0,0,0|1,0,1]=4 4036 B14R1.60 CC(Oc1ccccc1)C(=O)CCO 1458a_100000188414_100000211926 [1,1,0,0,0,0|1,0,1]=4 4037 B14R1.60 CCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210303 [1,1,0,0,0,0|0,0,2]=4 4038 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 11a_100015525214_100000188414 [1,1,0,0,0,0|1,0,1]=4 4039 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 240690a_100015525214_100000188414 [1,1,0,0,0,0|1,0,1]=4 4040 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000230173 [1,1,0,0,0,0|1,0,1]=4 4041 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 527a_100015525214_100000188414 [1,1,0,0,0,0|1,0,1]=4 4042 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000230173 [1,1,0,0,0,0|1,0,1]=4 4043 B14R1.60 CCOC(=O)C(C)Nc1ccccc1 34a_100000106764_100011216346 [1,1,0,0,0,0|1,0,1]=4 4044 B14R1.60 CCOC(=O)C(C)Oc1ccccc1 34a_100000210340_100011216346 [1,1,0,0,0,0|0,0,1]=3 4045 B14R1.60 CCOC(=O)C(C)Oc1ccccc1 7a_100000210340_100011216346 [1,1,0,0,0,0|0,0,1]=3 4046 B14R1.60 CCOC(=O)C(C)Oc1cccnc1 34a_100000210849_100011216346 [1,1,0,0,0,0|1,0,1]=4 4047 B14R1.60 CCOC(=O)C(C)Oc1cccnc1 7a_100000210849_100011216346 [1,1,0,0,0,0|1,0,1]=4 4048 B14R1.60 CCOC(=O)C(C)Oc1ccncc1 34a_100000212176_100011216346 [1,1,0,0,0,0|1,0,1]=4 4049 B14R1.60 CCOC(=O)C(C)Sc1ccccc1 62a_100000719477_100011216346 [1,1,0,0,0,0|0,1,1]=4 4050 B14R1.60 CCOC(=O)C(C)Sc1ccccc1 62a_100011216346_100000041952 [1,1,0,0,0,0|0,1,1]=4 4051 B14R1.60 CCOC(=O)C(F)Nc1ccccc1 34a_100000106764_100000760018 [1,1,0,0,0,0|1,0,1]=4 4052 B14R1.60 CCOC(=O)C(F)Oc1ccccc1 34a_100000210340_100000760018 [1,1,0,0,0,0|0,0,1]=3 4053 B14R1.60 CCOC(=O)C(F)Oc1ccccc1 7a_100000210340_100000040065 [1,1,0,0,0,0|0,0,1]=3 4054 B14R1.60 CCOC(=O)C(F)Oc1cccnc1 34a_100000210849_100000760018 [1,1,0,0,0,0|1,0,1]=4 4055 B14R1.60 CCOC(=O)C(F)Oc1cccnc1 7a_100000210849_100000040065 [1,1,0,0,0,0|1,0,1]=4 4056 B14R1.60 CCOC(=O)C(F)Oc1ccncc1 34a_100000212176_100000760018 [1,1,0,0,0,0|1,0,1]=4 4057 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 62a_100000719477_100000760018 [1,1,0,0,0,0|0,1,1]=4 4058 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 62a_100000760018_100000041952 [1,1,0,0,0,0|0,1,1]=4 4059 B14R1.502 C#CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000184674 [1,1,0,0,0,0|0,0,2]=4 4060 B14R1.502 C#CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000184674 [1,1,0,0,0,0|0,0,2]=4 4061 B14R1.502 C#CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000184674 [1,1,0,0,0,0|0,0,2]=4 4062 B14R1.502 C#CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000184674 [1,1,0,0,0,0|0,0,2]=4 4063 B14R1.502 C#CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000184674 [1,1,0,0,0,0|0,0,2]=4 4064 B14R1.502 C#CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000184674 [1,1,0,0,0,0|0,0,2]=4 4065 B14R1.502 C=CCC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_100000210623 [1,1,0,0,0,0|1,0,1]=4 4066 B14R1.502 C=CCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000210623 [1,1,0,0,0,0|1,0,1]=4 4067 B14R1.502 C=CCC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_100000210623 [1,1,0,0,0,0|1,0,1]=4 4068 B14R1.502 C=CCC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_100000210623 [1,1,0,0,0,0|1,0,1]=4 4069 B14R1.502 C=CCC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_100000210623 [1,1,0,0,0,0|1,0,1]=4 4070 B14R1.502 C=CCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000210623 [1,1,0,0,0,0|1,0,1]=4 4071 B14R1.502 C=CCC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_100000210623 [1,1,0,0,0,0|1,0,1]=4 4072 B14R1.502 C=CCC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_100000210623 [1,1,0,0,0,0|1,0,1]=4 4073 B14R1.502 C=CCC(=O)CCc1ccc(cc1)Br 1458a_100000210193_100011740612 [1,1,0,0,0,0|1,0,0]=3 4074 B14R1.502 C=CCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000210623 [1,1,0,0,0,0|1,0,0]=3 4075 B14R1.502 C=CCC(=O)CCc1ccc(cc1)C 1458a_100000210193_100011713686 [1,1,0,0,0,0|1,0,0]=3 4076 B14R1.502 C=CCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000210623 [1,1,0,0,0,0|1,0,0]=3 4077 B14R1.502 C=CCC(=O)CCc1ccc(cc1)Cl 1458a_100000210193_100011713675 [1,1,0,0,0,0|1,0,0]=3 4078 B14R1.502 C=CCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210623 [1,1,0,0,0,0|1,0,0]=3 4079 B14R1.502 C=CCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000210623 [1,1,0,0,0,0|1,0,0]=3 4080 B14R1.502 C=CCC(=O)CCc1ccc(cc1)F 1458a_100000210193_100011217392 [1,1,0,0,0,0|1,0,0]=3 4081 B14R1.502 C=CCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000210623 [1,1,0,0,0,0|1,0,0]=3 4082 B14R1.502 C=CCC(=O)CCc1ccc(cc1)O 1458a_100000210193_100009816426 [1,1,0,0,0,0|1,0,0]=3 4083 B14R1.502 C=CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210623 [1,1,0,0,0,0|1,0,0]=3 4084 B14R1.502 C=CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210623 [1,1,0,0,0,0|0,0,0]=2 4085 B14R1.502 C=CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210623 [1,1,0,0,0,0|0,0,0]=2 4086 B14R1.502 C=CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210623 [1,1,0,0,0,0|0,0,0]=2 4087 B14R1.502 C=CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210623 [1,1,0,0,0,0|0,0,0]=2 4088 B14R1.502 C=CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210623 [1,1,0,0,0,0|0,0,0]=2 4089 B14R1.502 C=CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210623 [1,1,0,0,0,0|0,0,0]=2 4090 B14R1.502 C=CCC(=O)COc1ncc(cn1)Br 1458a_200012356291_100000210623 [1,1,0,0,0,0|2,0,0]=4 4091 B14R1.502 C=CCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000210623 [1,1,0,0,0,0|0,1,0]=3 4092 B14R1.502 C=CCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000210623 [1,1,0,0,0,0|0,1,0]=3 4093 B14R1.502 C=CCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210623 [1,1,0,0,0,0|0,1,0]=3 4094 B14R1.502 C=CCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000210623 [1,1,0,0,0,0|0,1,0]=3 4095 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000210193 [1,1,0,0,0,0|2,0,0]=4 4096 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000210193 [1,1,0,0,0,0|2,0,0]=4 4097 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000210193 [1,1,0,0,0,0|2,0,0]=4 4098 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000210193 [1,1,0,0,0,0|2,0,0]=4 4099 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000210193 [1,1,0,0,0,0|2,0,0]=4 4100 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000210193 [1,1,0,0,0,0|2,0,0]=4 4101 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000210193 [1,1,0,0,0,0|2,0,0]=4 4102 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000210193 [1,1,0,0,0,0|2,0,0]=4 4103 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000210193 [1,1,0,0,0,0|2,0,0]=4 4104 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000210193 [1,1,0,0,0,0|2,0,0]=4 4105 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000210193 [1,1,0,0,0,0|2,0,0]=4 4106 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000210193 [1,1,0,0,0,0|2,0,0]=4 4107 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000210193 [1,1,0,0,0,0|2,0,0]=4 4108 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000210193 [1,1,0,0,0,0|2,0,0]=4 4109 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000210193 [1,1,0,0,0,0|2,0,0]=4 4110 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000210193 [1,1,0,0,0,0|2,0,0]=4 4111 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000210193 [1,1,0,0,0,0|2,0,0]=4 4112 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000210193 [1,1,0,0,0,0|2,0,0]=4 4113 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000210193 [1,1,0,0,0,0|2,0,0]=4 4114 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000210193 [1,1,0,0,0,0|2,0,0]=4 4115 B14R1.502 C=CCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210193 [1,1,0,0,0,0|2,0,0]=4 4116 B14R1.502 C=CCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000210193 [1,1,0,0,0,0|2,0,0]=4 4117 B14R1.502 C=CCC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000210193 [1,1,0,0,0,0|2,0,0]=4 4118 B14R1.502 C=CCC(=O)NNc1ccc(cc1)C 22a_100000683527_100000210193 [1,1,0,0,0,0|2,0,0]=4 4119 B14R1.502 C=CCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000210193 [1,1,0,0,0,0|2,0,0]=4 4120 B14R1.502 C=CCC(=O)NNc1ccc(cc1)F 22a_100000728448_100000210193 [1,1,0,0,0,0|2,0,0]=4 4121 B14R1.502 C=CCC(=O)NNc1ccc(cc1)I 22a_100016988836_100000210193 [1,1,0,0,0,0|2,0,0]=4 4122 B14R1.502 C=COC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000036128 [1,1,0,0,0,0|1,0,0]=3 4123 B14R1.502 C=COC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000036128 [1,1,0,0,0,0|1,0,0]=3 4124 B14R1.502 C=COC(=O)CNc1ccc(cc1)C 34a_100000124888_100000036128 [1,1,0,0,0,0|1,0,0]=3 4125 B14R1.502 C=COC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000036128 [1,1,0,0,0,0|1,0,0]=3 4126 B14R1.502 C=COC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000036128 [1,1,0,0,0,0|1,0,0]=3 4127 B14R1.502 C=COC(=O)CNc1ccc(cc1)F 34a_100000185862_100000036128 [1,1,0,0,0,0|1,0,0]=3 4128 B14R1.502 C=COC(=O)CNc1ccc(cc1)I 34a_100000185761_100000036128 [1,1,0,0,0,0|1,0,0]=3 4129 B14R1.502 C=COC(=O)CNc1ccc(cc1)O 34a_100000185829_100000036128 [1,1,0,0,0,0|1,0,0]=3 4130 B14R1.502 C=COC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000036128 [1,1,0,0,0,0|1,0,0]=3 4131 B14R1.502 C=COC(=O)COc1ccc(cc1)Br 34a_100000185759_100000036128 [1,1,0,0,0,0|0,0,0]=2 4132 B14R1.502 C=COC(=O)COc1ccc(cc1)C 34a_100000210336_100000036128 [1,1,0,0,0,0|0,0,0]=2 4133 B14R1.502 C=COC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000036128 [1,1,0,0,0,0|0,0,0]=2 4134 B14R1.502 C=COC(=O)COc1ccc(cc1)F 34a_100000210339_100000036128 [1,1,0,0,0,0|0,0,0]=2 4135 B14R1.502 C=COC(=O)COc1ccc(cc1)I 34a_100000212066_100000036128 [1,1,0,0,0,0|0,0,0]=2 4136 B14R1.502 C=COC(=O)COc1ccc(cc1)N 34a_100000185829_100000036128 [1,1,0,0,0,0|0,0,0]=2 4137 B14R1.502 C=COC(=O)COc1ccc(cn1)C 34a_100000759353_100000036128 [1,1,0,0,0,0|1,0,0]=3 4138 B14R1.502 C=COC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000036128 [1,1,0,0,0,0|1,0,0]=3 4139 B14R1.502 C=COC(=O)COc1ccc(cn1)F 34a_100000742473_100000036128 [1,1,0,0,0,0|1,0,0]=3 4140 B14R1.502 C=COC(=O)COc1ccc(cn1)N 34a_100000729260_100000036128 [1,1,0,0,0,0|1,0,0]=3 4141 B14R1.502 C=COC(=O)COc1ccc(nc1)Br 34a_100000685995_100000036128 [1,1,0,0,0,0|1,0,0]=3 4142 B14R1.502 C=COC(=O)COc1ccc(nc1)C 34a_100000745506_100000036128 [1,1,0,0,0,0|1,0,0]=3 4143 B14R1.502 C=COC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000036128 [1,1,0,0,0,0|1,0,0]=3 4144 B14R1.502 C=COC(=O)COc1ccc(nc1)F 34a_100000688820_100000036128 [1,1,0,0,0,0|1,0,0]=3 4145 B14R1.502 C=COC(=O)COc1ccc(nc1)I 34a_100000687607_100000036128 [1,1,0,0,0,0|1,0,0]=3 4146 B14R1.502 C=COC(=O)COc1ccc(nc1)N 34a_100015188713_100000036128 [1,1,0,0,0,0|1,0,0]=3 4147 B14R1.502 C=COC(=O)COc1cnc(cn1)Br 34a_100011934580_100000036128 [1,1,0,0,0,0|2,0,0]=4 4148 B14R1.502 C=COC(=O)COc1cnc(cn1)Cl 34a_100015839800_100000036128 [1,1,0,0,0,0|2,0,0]=4 4149 B14R1.502 C=COC(=O)COc1cnc(nc1)Br 34a_100000730009_100000036128 [1,1,0,0,0,0|2,0,0]=4 4150 B14R1.502 C=COC(=O)COc1cnc(nc1)C 34a_100000062939_100000036128 [1,1,0,0,0,0|2,0,0]=4 4151 B14R1.502 C=COC(=O)COc1cnc(nc1)Cl 34a_100000092845_100000036128 [1,1,0,0,0,0|2,0,0]=4 4152 B14R1.502 C=COC(=O)COc1cnc(nc1)F 34a_200009874573_100000036128 [1,1,0,0,0,0|2,0,0]=4 4153 B14R1.502 C=COC(=O)COc1cnc(nc1)N 34a_100000087137_100000036128 [1,1,0,0,0,0|2,0,0]=4 4154 B14R1.502 C=COC(=O)COc1ncc(cn1)F 34a_100011934040_100000036128 [1,1,0,0,0,0|2,0,0]=4 4155 B14R1.502 C=COC(=O)CSc1cc[n+](cc1)[O-] 62a_100000036128_100000039755 [1,1,0,0,0,0|1,1,0]=4 4156 B14R1.502 C=COC(=O)CSc1ccc(=O)[nH]c1 62a_100000036128_100000212171 [1,1,0,0,0,0|1,1,0]=4 4157 B14R1.502 C=COC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000036128 [1,1,0,0,0,0|1,1,0]=4 4158 B14R1.502 C=COC(=O)CSc1ccc(cc1)Br 62a_100000036128_100000752885 [1,1,0,0,0,0|0,1,0]=3 4159 B14R1.502 C=COC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000036128 [1,1,0,0,0,0|0,1,0]=3 4160 B14R1.502 C=COC(=O)CSc1ccc(cc1)C 62a_100000036128_100000186775 [1,1,0,0,0,0|0,1,0]=3 4161 B14R1.502 C=COC(=O)CSc1ccc(cc1)C 62a_100000186775_100000036128 [1,1,0,0,0,0|0,1,0]=3 4162 B14R1.502 C=COC(=O)CSc1ccc(cc1)Cl 62a_100000036128_100000755918 [1,1,0,0,0,0|0,1,0]=3 4163 B14R1.502 C=COC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000036128 [1,1,0,0,0,0|0,1,0]=3 4164 B14R1.502 C=COC(=O)CSc1ccc(cc1)F 62a_100000036128_100000211213 [1,1,0,0,0,0|0,1,0]=3 4165 B14R1.502 C=COC(=O)CSc1ccc(cc1)F 62a_100000211213_100000036128 [1,1,0,0,0,0|0,1,0]=3 4166 B14R1.502 C=COC(=O)CSc1ccc(cc1)N 62a_100000036128_100000185761 [1,1,0,0,0,0|0,1,0]=3 4167 B14R1.502 C=COC(=O)CSc1ccc(cc1)N 62a_100000185761_100000036128 [1,1,0,0,0,0|0,1,0]=3 4168 B14R1.502 C=COC(=O)CSc1ccc(cc1)O 62a_100000036128_100000185759 [1,1,0,0,0,0|0,1,0]=3 4169 B14R1.502 C=COC(=O)CSc1ccc(cn1)Br 62a_100000036128_100000686858 [1,1,0,0,0,0|1,1,0]=4 4170 B14R1.502 C=COC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000036128 [1,1,0,0,0,0|1,1,0]=4 4171 B14R1.502 C=COC(=O)CSc1ccc(cn1)C 62a_100000036128_100000754016 [1,1,0,0,0,0|1,1,0]=4 4172 B14R1.502 C=COC(=O)CSc1ccc(cn1)C 62a_100011192072_100000036128 [1,1,0,0,0,0|1,1,0]=4 4173 B14R1.502 C=COC(=O)CSc1ccc(cn1)Cl 62a_100000036128_100011356976 [1,1,0,0,0,0|1,1,0]=4 4174 B14R1.502 C=COC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000036128 [1,1,0,0,0,0|1,1,0]=4 4175 B14R1.502 C=COC(=O)CSc1ccc(cn1)F 62a_100000036128_100000744514 [1,1,0,0,0,0|1,1,0]=4 4176 B14R1.502 C=COC(=O)CSc1ccc(cn1)F 62a_100000744514_100000036128 [1,1,0,0,0,0|1,1,0]=4 4177 B14R1.502 C=COC(=O)CSc1ccc(cn1)N 62a_100000036128_100000737798 [1,1,0,0,0,0|1,1,0]=4 4178 B14R1.502 C=COC(=O)CSc1ccc(cn1)N 62a_100000737798_100000036128 [1,1,0,0,0,0|1,1,0]=4 4179 B14R1.502 C=COC(=O)CSc1ccc(cn1)O 62a_100000036128_100000744096 [1,1,0,0,0,0|1,1,0]=4 4180 B14R1.502 C=COC(=O)CSc1ccc(cn1)O 62a_100000685995_100000036128 [1,1,0,0,0,0|1,1,0]=4 4181 B14R1.502 C=COC(=O)CSc1ccc(nc1)Br 62a_100000036128_100009814638 [1,1,0,0,0,0|1,1,0]=4 4182 B14R1.502 C=COC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000036128 [1,1,0,0,0,0|1,1,0]=4 4183 B14R1.502 C=COC(=O)CSc1ccc(nc1)C 62a_100000036128_100000751577 [1,1,0,0,0,0|1,1,0]=4 4184 B14R1.502 C=COC(=O)CSc1ccc(nc1)C 62a_100000751577_100000036128 [1,1,0,0,0,0|1,1,0]=4 4185 B14R1.502 C=COC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000036128 [1,1,0,0,0,0|1,1,0]=4 4186 B14R1.502 C=COC(=O)CSc1ccc(nc1)Cl 62a_100000036128_100000034144 [1,1,0,0,0,0|1,1,0]=4 4187 B14R1.502 C=COC(=O)CSc1ccc(nc1)F 62a_100000036128_100000042367 [1,1,0,0,0,0|1,1,0]=4 4188 B14R1.502 C=COC(=O)CSc1ccc(nc1)F 62a_100000042367_100000036128 [1,1,0,0,0,0|1,1,0]=4 4189 B14R1.502 C=COC(=O)CSc1ccc(nc1)N 62a_100000036128_100000187370 [1,1,0,0,0,0|1,1,0]=4 4190 B14R1.502 C=COC(=O)CSc1ccc(nc1)N 62a_100000187370_100000036128 [1,1,0,0,0,0|1,1,0]=4 4191 B14R1.502 CCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210303 [1,1,0,0,0,0|0,0,2]=4 4192 B14R1.502 CCCC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747444 [1,1,0,0,0,0|0,0,2]=4 4193 B14R1.502 CCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210303 [1,1,0,0,0,0|0,0,2]=4 4194 B14R1.502 CCCC(=O)COc1ccc(cc1)C 7a_100000210336_100000747444 [1,1,0,0,0,0|0,0,2]=4 4195 B14R1.502 CCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210303 [1,1,0,0,0,0|0,0,2]=4 4196 B14R1.502 CCCC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747444 [1,1,0,0,0,0|0,0,2]=4 4197 B14R1.502 CCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210303 [1,1,0,0,0,0|0,0,2]=4 4198 B14R1.502 CCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210303 [1,1,0,0,0,0|0,0,2]=4 4199 B14R1.502 CCCC(=O)COc1ccc(cc1)I 7a_100000212066_100000747444 [1,1,0,0,0,0|0,0,2]=4 4200 B14R1.502 CCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210303 [1,1,0,0,0,0|0,0,2]=4 4201 B14R1.502 CCNC(=O)COc1ccc(cc1)Br 11a_100015525214_100000182358 [1,1,0,0,0,0|1,0,1]=4 4202 B14R1.502 CCNC(=O)COc1ccc(cc1)Br 240690a_100015525214_100000182358 [1,1,0,0,0,0|1,0,1]=4 4203 B14R1.502 CCNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183381 [1,1,0,0,0,0|1,0,1]=4 4204 B14R1.502 CCNC(=O)COc1ccc(cc1)Br 527a_100015525214_100000182358 [1,1,0,0,0,0|1,0,1]=4 4205 B14R1.502 CCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183381 [1,1,0,0,0,0|1,0,1]=4 4206 B14R1.502 CCNC(=O)COc1ccc(cc1)C 11a_100015525214_100000182360 [1,1,0,0,0,0|1,0,1]=4 4207 B14R1.502 CCNC(=O)COc1ccc(cc1)C 240690a_100015525214_100000182360 [1,1,0,0,0,0|1,0,1]=4 4208 B14R1.502 CCNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183381 [1,1,0,0,0,0|1,0,1]=4 4209 B14R1.502 CCNC(=O)COc1ccc(cc1)C 527a_100015525214_100000182360 [1,1,0,0,0,0|1,0,1]=4 4210 B14R1.502 CCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183381 [1,1,0,0,0,0|1,0,1]=4 4211 B14R1.502 CCNC(=O)COc1ccc(cc1)Cl 11a_100015525214_100016990877 [1,1,0,0,0,0|1,0,1]=4 4212 B14R1.502 CCNC(=O)COc1ccc(cc1)Cl 240690a_100015525214_100016990877 [1,1,0,0,0,0|1,0,1]=4 4213 B14R1.502 CCNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183381 [1,1,0,0,0,0|1,0,1]=4 4214 B14R1.502 CCNC(=O)COc1ccc(cc1)Cl 527a_100015525214_100016990877 [1,1,0,0,0,0|1,0,1]=4 4215 B14R1.502 CCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183381 [1,1,0,0,0,0|1,0,1]=4 4216 B14R1.502 CCNC(=O)COc1ccc(cc1)F 11a_100015525214_100000184765 [1,1,0,0,0,0|1,0,1]=4 4217 B14R1.502 CCNC(=O)COc1ccc(cc1)F 240690a_100015525214_100000184765 [1,1,0,0,0,0|1,0,1]=4 4218 B14R1.502 CCNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183381 [1,1,0,0,0,0|1,0,1]=4 4219 B14R1.502 CCNC(=O)COc1ccc(cc1)F 527a_100015525214_100000184765 [1,1,0,0,0,0|1,0,1]=4 4220 B14R1.502 CCNC(=O)COc1ccc(cc1)I 11a_100015525214_100000184369 [1,1,0,0,0,0|1,0,1]=4 4221 B14R1.502 CCNC(=O)COc1ccc(cc1)I 240690a_100015525214_100000184369 [1,1,0,0,0,0|1,0,1]=4 4222 B14R1.502 CCNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183381 [1,1,0,0,0,0|1,0,1]=4 4223 B14R1.502 CCNC(=O)COc1ccc(cc1)I 527a_100015525214_100000184369 [1,1,0,0,0,0|1,0,1]=4 4224 B14R1.502 CCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183381 [1,1,0,0,0,0|1,0,1]=4 4225 B14R1.502 CCNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183381 [1,1,0,0,0,0|1,0,1]=4 4226 B14R1.502 CCNC(=O)COc1ccc(cc1)O 240690a_100015525214_100000031633 [1,1,0,0,0,0|1,0,1]=4 4227 B14R1.502 CCNC(=O)COc1ccc(cc1)O 527a_100015525214_100000031633 [1,1,0,0,0,0|1,0,1]=4 4228 B14R1.502 CCOC(=O)CCc1ccc(cc1)O 271570a_203496583355_100012353604 [1,1,0,0,0,0|1,0,1]=4 4229 B14R1.502 CCOC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000188475 [1,1,0,0,0,0|1,0,1]=4 4230 B14R1.502 CCOC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000188475 [1,1,0,0,0,0|1,0,1]=4 4231 B14R1.502 CCOC(=O)CNc1ccc(cc1)C 34a_100000124888_100000188475 [1,1,0,0,0,0|1,0,1]=4 4232 B14R1.502 CCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000188475 [1,1,0,0,0,0|1,0,1]=4 4233 B14R1.502 CCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000188475 [1,1,0,0,0,0|1,0,1]=4 4234 B14R1.502 CCOC(=O)CNc1ccc(cc1)F 34a_100000185862_100000188475 [1,1,0,0,0,0|1,0,1]=4 4235 B14R1.502 CCOC(=O)CNc1ccc(cc1)I 34a_100000185761_100000188475 [1,1,0,0,0,0|1,0,1]=4 4236 B14R1.502 CCOC(=O)CNc1ccc(cc1)O 271570a_203496583355_200000220479 [1,1,0,0,0,0|1,0,1]=4 4237 B14R1.502 CCOC(=O)CNc1ccc(cc1)O 34a_100000185829_100000188475 [1,1,0,0,0,0|1,0,1]=4 4238 B14R1.502 CCOC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000188475 [1,1,0,0,0,0|1,0,1]=4 4239 B14R1.502 CCOC(=O)COc1ccc(cc1)Br 34a_100000185759_100000188475 [1,1,0,0,0,0|0,0,1]=3 4240 B14R1.502 CCOC(=O)COc1ccc(cc1)Br 7a_100000185759_100000188475 [1,1,0,0,0,0|0,0,1]=3 4241 B14R1.502 CCOC(=O)COc1ccc(cc1)C 34a_100000210336_100000188475 [1,1,0,0,0,0|0,0,1]=3 4242 B14R1.502 CCOC(=O)COc1ccc(cc1)C 7a_100000210336_100000188475 [1,1,0,0,0,0|0,0,1]=3 4243 B14R1.502 CCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000188475 [1,1,0,0,0,0|0,0,1]=3 4244 B14R1.502 CCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000188475 [1,1,0,0,0,0|0,0,1]=3 4245 B14R1.502 CCOC(=O)COc1ccc(cc1)F 34a_100000210339_100000188475 [1,1,0,0,0,0|0,0,1]=3 4246 B14R1.502 CCOC(=O)COc1ccc(cc1)I 34a_100000212066_100000188475 [1,1,0,0,0,0|0,0,1]=3 4247 B14R1.502 CCOC(=O)COc1ccc(cc1)I 7a_100000212066_100000188475 [1,1,0,0,0,0|0,0,1]=3 4248 B14R1.502 CCOC(=O)COc1ccc(cc1)N 34a_100000185829_100000188475 [1,1,0,0,0,0|0,0,1]=3 4249 B14R1.502 CCOC(=O)COc1ccc(cc1)O 271570a_203496583355_100000170664 [1,1,0,0,0,0|0,0,1]=3 4250 B14R1.502 CCOC(=O)COc1ccc(cn1)C 34a_100000759353_100000188475 [1,1,0,0,0,0|1,0,1]=4 4251 B14R1.502 CCOC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000188475 [1,1,0,0,0,0|1,0,1]=4 4252 B14R1.502 CCOC(=O)COc1ccc(cn1)F 34a_100000742473_100000188475 [1,1,0,0,0,0|1,0,1]=4 4253 B14R1.502 CCOC(=O)COc1ccc(cn1)N 34a_100000729260_100000188475 [1,1,0,0,0,0|1,0,1]=4 4254 B14R1.502 CCOC(=O)COc1ccc(nc1)Br 34a_100000685995_100000188475 [1,1,0,0,0,0|1,0,1]=4 4255 B14R1.502 CCOC(=O)COc1ccc(nc1)Br 7a_100000685995_100000188475 [1,1,0,0,0,0|1,0,1]=4 4256 B14R1.502 CCOC(=O)COc1ccc(nc1)C 34a_100000745506_100000188475 [1,1,0,0,0,0|1,0,1]=4 4257 B14R1.502 CCOC(=O)COc1ccc(nc1)C 7a_100000745506_100000188475 [1,1,0,0,0,0|1,0,1]=4 4258 B14R1.502 CCOC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000188475 [1,1,0,0,0,0|1,0,1]=4 4259 B14R1.502 CCOC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000188475 [1,1,0,0,0,0|1,0,1]=4 4260 B14R1.502 CCOC(=O)COc1ccc(nc1)F 34a_100000688820_100000188475 [1,1,0,0,0,0|1,0,1]=4 4261 B14R1.502 CCOC(=O)COc1ccc(nc1)F 7a_100000688820_100000188475 [1,1,0,0,0,0|1,0,1]=4 4262 B14R1.502 CCOC(=O)COc1ccc(nc1)I 34a_100000687607_100000188475 [1,1,0,0,0,0|1,0,1]=4 4263 B14R1.502 CCOC(=O)COc1ccc(nc1)I 7a_100000687607_100000188475 [1,1,0,0,0,0|1,0,1]=4 4264 B14R1.502 CCOC(=O)COc1ccc(nc1)N 34a_100015188713_100000188475 [1,1,0,0,0,0|1,0,1]=4 4265 B14R1.502 CCOC(=O)COc1ccc(nc1)N 7a_100015188713_100000188475 [1,1,0,0,0,0|1,0,1]=4 4266 B14R1.502 CCOC(=O)CSc1ccc(cc1)Br 62a_100000188475_100000752885 [1,1,0,0,0,0|0,1,1]=4 4267 B14R1.502 CCOC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000188475 [1,1,0,0,0,0|0,1,1]=4 4268 B14R1.502 CCOC(=O)CSc1ccc(cc1)C 62a_100000186775_100000188475 [1,1,0,0,0,0|0,1,1]=4 4269 B14R1.502 CCOC(=O)CSc1ccc(cc1)C 62a_100000188475_100000186775 [1,1,0,0,0,0|0,1,1]=4 4270 B14R1.502 CCOC(=O)CSc1ccc(cc1)Cl 62a_100000188475_100000755918 [1,1,0,0,0,0|0,1,1]=4 4271 B14R1.502 CCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000188475 [1,1,0,0,0,0|0,1,1]=4 4272 B14R1.502 CCOC(=O)CSc1ccc(cc1)F 62a_100000188475_100000211213 [1,1,0,0,0,0|0,1,1]=4 4273 B14R1.502 CCOC(=O)CSc1ccc(cc1)F 62a_100000211213_100000188475 [1,1,0,0,0,0|0,1,1]=4 4274 B14R1.502 CCOC(=O)CSc1ccc(cc1)N 62a_100000185761_100000188475 [1,1,0,0,0,0|0,1,1]=4 4275 B14R1.502 CCOC(=O)CSc1ccc(cc1)N 62a_100000188475_100000185761 [1,1,0,0,0,0|0,1,1]=4 4276 B14R1.502 CCOC(=O)CSc1ccc(cc1)O 62a_100000188475_100000185759 [1,1,0,0,0,0|0,1,1]=4 4277 B14R1.502 Cc1ccc(cc1)OCC(=O)CC#N 1458a_100000182360_100011214920 [1,1,0,0,0,0|1,0,1]=4 4278 B14R1.502 Cc1ccc(cc1)OCC(=O)CCF 1458a_100000182360_100011217306 [1,1,0,0,0,0|1,0,1]=4 4279 B14R1.502 Cc1ccc(cc1)OCC(=O)CCO 1458a_100000182360_100000211926 [1,1,0,0,0,0|1,0,1]=4 4280 B14R1.502 Cc1ccc(cc1)OCC(=O)NCO 34a_100000210336_100000185155 [1,1,0,0,0,0|2,0,0]=4 4281 B14R1.502 Cc1ccc(cc1)OCC(=O)NCO 7a_100000210336_100000185155 [1,1,0,0,0,0|2,0,0]=4 4282 B14R1.502 N#CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100011214920 [1,1,0,0,0,0|1,0,1]=4 4283 B14R1.502 N#CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100011214920 [1,1,0,0,0,0|1,0,1]=4 4284 B14R1.502 N#CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100011214920 [1,1,0,0,0,0|1,0,1]=4 4285 B14R1.502 N#CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100011214920 [1,1,0,0,0,0|1,0,1]=4 4286 B14R1.502 N#CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100011214920 [1,1,0,0,0,0|1,0,1]=4 4287 B14R1.502 Nc1ccc(cc1)OCC(=O)NCO 34a_100000185829_100000185155 [1,1,0,0,0,0|2,0,0]=4 4288 B14R1.502 O=C(CCF)COc1ccc(cc1)Br 1458a_100000182358_100011217306 [1,1,0,0,0,0|1,0,1]=4 4289 B14R1.502 O=C(CCF)COc1ccc(cc1)Cl 1458a_100016990877_100011217306 [1,1,0,0,0,0|1,0,1]=4 4290 B14R1.502 O=C(CCF)COc1ccc(cc1)F 1458a_100000184765_100011217306 [1,1,0,0,0,0|1,0,1]=4 4291 B14R1.502 O=C(CCF)COc1ccc(cc1)I 1458a_100000184369_100011217306 [1,1,0,0,0,0|1,0,1]=4 4292 B14R1.502 O=C(CCF)COc1ccc(cc1)O 1458a_100000031633_100011217306 [1,1,0,0,0,0|1,0,1]=4 4293 B14R1.502 O=C(CCO)COc1ccc(cc1)Br 1458a_100000182358_100000211926 [1,1,0,0,0,0|1,0,1]=4 4294 B14R1.502 O=C(CCO)COc1ccc(cc1)Cl 1458a_100016990877_100000211926 [1,1,0,0,0,0|1,0,1]=4 4295 B14R1.502 O=C(CCO)COc1ccc(cc1)F 1458a_100000184765_100000211926 [1,1,0,0,0,0|1,0,1]=4 4296 B14R1.502 O=C(CCO)COc1ccc(cc1)I 1458a_100000184369_100000211926 [1,1,0,0,0,0|1,0,1]=4 4297 B14R1.502 O=C(CCO)COc1ccc(cc1)O 1458a_100000031633_100000211926 [1,1,0,0,0,0|1,0,1]=4 4298 B14R1.502 O=C(COc1ccc(cc1)Br)NCO 34a_100000185759_100000185155 [1,1,0,0,0,0|2,0,0]=4 4299 B14R1.502 O=C(COc1ccc(cc1)Br)NCO 7a_100000185759_100000185155 [1,1,0,0,0,0|2,0,0]=4 4300 B14R1.502 O=C(COc1ccc(cc1)Cl)NCO 34a_100000210216_100000185155 [1,1,0,0,0,0|2,0,0]=4 4301 B14R1.502 O=C(COc1ccc(cc1)Cl)NCO 7a_100000210216_100000185155 [1,1,0,0,0,0|2,0,0]=4 4302 B14R1.502 O=C(COc1ccc(cc1)F)NCO 34a_100000210339_100000185155 [1,1,0,0,0,0|2,0,0]=4 4303 B14R1.502 O=C(COc1ccc(cc1)I)NCO 34a_100000212066_100000185155 [1,1,0,0,0,0|2,0,0]=4 4304 B14R1.502 O=C(COc1ccc(cc1)I)NCO 7a_100000212066_100000185155 [1,1,0,0,0,0|2,0,0]=4 4305 B14R1.598 C#CCC(=O)COc1ccccc1Br 1458a_100000216496_100000184674 [1,1,0,0,0,0|0,0,2]=4 4306 B14R1.598 C#CCC(=O)COc1ccccc1C 1458a_100000182418_100000184674 [1,1,0,0,0,0|0,0,2]=4 4307 B14R1.598 C#CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000184674 [1,1,0,0,0,0|0,0,2]=4 4308 B14R1.598 C#CCC(=O)COc1ccccc1F 1458a_100000182486_100000184674 [1,1,0,0,0,0|0,0,2]=4 4309 B14R1.598 C#CCC(=O)COc1ccccc1O 1458a_100000183020_100000184674 [1,1,0,0,0,0|0,0,2]=4 4310 B14R1.598 C=CCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000210623 [1,1,0,0,0,0|1,0,1]=4 4311 B14R1.598 C=CCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000210623 [1,1,0,0,0,0|1,0,1]=4 4312 B14R1.598 C=CCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000210623 [1,1,0,0,0,0|1,0,1]=4 4313 B14R1.598 C=CCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000210623 [1,1,0,0,0,0|1,0,1]=4 4314 B14R1.598 C=CCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210623 [1,1,0,0,0,0|1,0,1]=4 4315 B14R1.598 C=CCC(=O)CCc1ccccc1Br 1458a_100000210193_100012161201 [1,1,0,0,0,0|1,0,0]=3 4316 B14R1.598 C=CCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210623 [1,1,0,0,0,0|1,0,0]=3 4317 B14R1.598 C=CCC(=O)CCc1ccccc1C 1458a_100000210193_100011713688 [1,1,0,0,0,0|1,0,0]=3 4318 B14R1.598 C=CCC(=O)CCc1ccccc1C 1458a_100000748742_100000210623 [1,1,0,0,0,0|1,0,0]=3 4319 B14R1.598 C=CCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210623 [1,1,0,0,0,0|1,0,0]=3 4320 B14R1.598 C=CCC(=O)CCc1ccccc1Cl 1458a_100000210193_100011713703 [1,1,0,0,0,0|1,0,0]=3 4321 B14R1.598 C=CCC(=O)CCc1ccccc1F 1458a_100000189703_100000210623 [1,1,0,0,0,0|1,0,0]=3 4322 B14R1.598 C=CCC(=O)CCc1ccccc1F 1458a_100000210193_100000720011 [1,1,0,0,0,0|1,0,0]=3 4323 B14R1.598 C=CCC(=O)CCc1ccccc1I 1458a_100000037306_100000210623 [1,1,0,0,0,0|1,0,0]=3 4324 B14R1.598 C=CCC(=O)CCc1ccccc1O 1458a_100000181328_100000210623 [1,1,0,0,0,0|1,0,0]=3 4325 B14R1.598 C=CCC(=O)CCc1ccccc1O 1458a_100000210193_100000722297 [1,1,0,0,0,0|1,0,0]=3 4326 B14R1.598 C=CCC(=O)CCn1ccccc1=O 1458a_100000738505_100000210623 [1,1,0,0,0,0|2,0,0]=4 4327 B14R1.598 C=CCC(=O)COc1ccccc1Br 1458a_100000216496_100000210623 [1,1,0,0,0,0|0,0,0]=2 4328 B14R1.598 C=CCC(=O)COc1ccccc1C 1458a_100000182418_100000210623 [1,1,0,0,0,0|0,0,0]=2 4329 B14R1.598 C=CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210623 [1,1,0,0,0,0|0,0,0]=2 4330 B14R1.598 C=CCC(=O)COc1ccccc1F 1458a_100000182486_100000210623 [1,1,0,0,0,0|0,0,0]=2 4331 B14R1.598 C=CCC(=O)COc1ccccc1O 1458a_100000183020_100000210623 [1,1,0,0,0,0|0,0,0]=2 4332 B14R1.598 C=CCC(=O)CSc1ccccc1C 1458a_100000183026_100000210623 [1,1,0,0,0,0|0,1,0]=3 4333 B14R1.598 C=CCC(=O)CSc1ccccc1F 1458a_100000179528_100000210623 [1,1,0,0,0,0|0,1,0]=3 4334 B14R1.598 C=CCC(=O)CSc1ccccc1O 1458a_100000695322_100000210623 [1,1,0,0,0,0|0,1,0]=3 4335 B14R1.598 C=CCC(=O)NCc1ccccc1Br 11a_100000689332_100000210193 [1,1,0,0,0,0|2,0,0]=4 4336 B14R1.598 C=CCC(=O)NCc1ccccc1Br 1626a_100000689332_100000210193 [1,1,0,0,0,0|2,0,0]=4 4337 B14R1.598 C=CCC(=O)NCc1ccccc1Br 240690a_100000689332_100000210193 [1,1,0,0,0,0|2,0,0]=4 4338 B14R1.598 C=CCC(=O)NCc1ccccc1Br 527a_100000689332_100000210193 [1,1,0,0,0,0|2,0,0]=4 4339 B14R1.598 C=CCC(=O)NCc1ccccc1C 11a_100000174972_100000210193 [1,1,0,0,0,0|2,0,0]=4 4340 B14R1.598 C=CCC(=O)NCc1ccccc1C 1626a_100000174972_100000210193 [1,1,0,0,0,0|2,0,0]=4 4341 B14R1.598 C=CCC(=O)NCc1ccccc1C 240690a_100000174972_100000210193 [1,1,0,0,0,0|2,0,0]=4 4342 B14R1.598 C=CCC(=O)NCc1ccccc1C 527a_100000174972_100000210193 [1,1,0,0,0,0|2,0,0]=4 4343 B14R1.598 C=CCC(=O)NCc1ccccc1Cl 11a_100000174879_100000210193 [1,1,0,0,0,0|2,0,0]=4 4344 B14R1.598 C=CCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000210193 [1,1,0,0,0,0|2,0,0]=4 4345 B14R1.598 C=CCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000210193 [1,1,0,0,0,0|2,0,0]=4 4346 B14R1.598 C=CCC(=O)NCc1ccccc1Cl 527a_100000174879_100000210193 [1,1,0,0,0,0|2,0,0]=4 4347 B14R1.598 C=CCC(=O)NCc1ccccc1F 11a_100000174869_100000210193 [1,1,0,0,0,0|2,0,0]=4 4348 B14R1.598 C=CCC(=O)NCc1ccccc1F 1626a_100000174869_100000210193 [1,1,0,0,0,0|2,0,0]=4 4349 B14R1.598 C=CCC(=O)NCc1ccccc1F 240690a_100000174869_100000210193 [1,1,0,0,0,0|2,0,0]=4 4350 B14R1.598 C=CCC(=O)NCc1ccccc1F 527a_100000174869_100000210193 [1,1,0,0,0,0|2,0,0]=4 4351 B14R1.598 C=CCC(=O)NCc1ccccc1I 11a_100015347259_100000210193 [1,1,0,0,0,0|2,0,0]=4 4352 B14R1.598 C=CCC(=O)NCc1ccccc1I 1626a_100015347259_100000210193 [1,1,0,0,0,0|2,0,0]=4 4353 B14R1.598 C=CCC(=O)NCc1ccccc1I 240690a_100015347259_100000210193 [1,1,0,0,0,0|2,0,0]=4 4354 B14R1.598 C=CCC(=O)NCc1ccccc1I 527a_100015347259_100000210193 [1,1,0,0,0,0|2,0,0]=4 4355 B14R1.598 C=CCC(=O)NCc1ccccc1O 240690a_100000185550_100000210193 [1,1,0,0,0,0|2,0,0]=4 4356 B14R1.598 C=CCC(=O)NCc1ccccc1O 527a_100000185550_100000210193 [1,1,0,0,0,0|2,0,0]=4 4357 B14R1.598 C=CCC(=O)NNc1ccccc1Br 22a_100000241748_100000210193 [1,1,0,0,0,0|2,0,0]=4 4358 B14R1.598 C=CCC(=O)NNc1ccccc1C 22a_100000184220_100000210193 [1,1,0,0,0,0|2,0,0]=4 4359 B14R1.598 C=CCC(=O)NNc1ccccc1Cl 22a_100000683529_100000210193 [1,1,0,0,0,0|2,0,0]=4 4360 B14R1.598 C=CCC(=O)NNc1ccccc1F 22a_100000239246_100000210193 [1,1,0,0,0,0|2,0,0]=4 4361 B14R1.598 C=CCC(=O)NNc1ccccc1I 22a_100011218156_100000210193 [1,1,0,0,0,0|2,0,0]=4 4362 B14R1.598 C=COC(=O)CNc1ccccc1Br 34a_100000210017_100000036128 [1,1,0,0,0,0|1,0,0]=3 4363 B14R1.598 C=COC(=O)CNc1ccccc1C 34a_100015192222_100000036128 [1,1,0,0,0,0|1,0,0]=3 4364 B14R1.598 C=COC(=O)CNc1ccccc1Cl 34a_100000185783_100000036128 [1,1,0,0,0,0|1,0,0]=3 4365 B14R1.598 C=COC(=O)CNc1ccccc1F 34a_100000210422_100000036128 [1,1,0,0,0,0|1,0,0]=3 4366 B14R1.598 C=COC(=O)CNc1ccccc1I 34a_100000210053_100000036128 [1,1,0,0,0,0|1,0,0]=3 4367 B14R1.598 C=COC(=O)CNc1ccccc1O 34a_100000185747_100000036128 [1,1,0,0,0,0|1,0,0]=3 4368 B14R1.598 C=COC(=O)COc1ccccc1Br 34a_100000181306_100000036128 [1,1,0,0,0,0|0,0,0]=2 4369 B14R1.598 C=COC(=O)COc1ccccc1C 34a_100000210338_100000036128 [1,1,0,0,0,0|0,0,0]=2 4370 B14R1.598 C=COC(=O)COc1ccccc1Cl 34a_100000210172_100000036128 [1,1,0,0,0,0|0,0,0]=2 4371 B14R1.598 C=COC(=O)COc1ccccc1F 34a_100000210171_100000036128 [1,1,0,0,0,0|0,0,0]=2 4372 B14R1.598 C=COC(=O)COc1ccccc1I 34a_100000739446_100000036128 [1,1,0,0,0,0|0,0,0]=2 4373 B14R1.598 C=COC(=O)COc1ccccc1N 34a_100000185747_100000036128 [1,1,0,0,0,0|0,0,0]=2 4374 B14R1.598 C=COC(=O)COc1cccnc1Br 34a_100000744436_100000036128 [1,1,0,0,0,0|1,0,0]=3 4375 B14R1.598 C=COC(=O)COc1cccnc1C 34a_100000745507_100000036128 [1,1,0,0,0,0|1,0,0]=3 4376 B14R1.598 C=COC(=O)COc1cccnc1Cl 34a_100000757616_100000036128 [1,1,0,0,0,0|1,0,0]=3 4377 B14R1.598 C=COC(=O)COc1cccnc1F 34a_100000061740_100000036128 [1,1,0,0,0,0|1,0,0]=3 4378 B14R1.598 C=COC(=O)COc1cccnc1I 34a_100000034122_100000036128 [1,1,0,0,0,0|1,0,0]=3 4379 B14R1.598 C=COC(=O)COc1cccnc1N 34a_100000211975_100000036128 [1,1,0,0,0,0|1,0,0]=3 4380 B14R1.598 C=COC(=O)COc1cccoc1=O 34a_100000077404_100000036128 [1,1,0,0,0,0|1,0,0]=3 4381 B14R1.598 C=COC(=O)COc1ccncc1Br 34a_100011996408_100000036128 [1,1,0,0,0,0|1,0,0]=3 4382 B14R1.598 C=COC(=O)COc1ccncc1C 34a_100000694293_100000036128 [1,1,0,0,0,0|1,0,0]=3 4383 B14R1.598 C=COC(=O)COc1ccncc1Cl 34a_100011997054_100000036128 [1,1,0,0,0,0|1,0,0]=3 4384 B14R1.598 C=COC(=O)COc1ccncc1F 34a_200000081243_100000036128 [1,1,0,0,0,0|1,0,0]=3 4385 B14R1.598 C=COC(=O)COc1cnccc1C 34a_100011997053_100000036128 [1,1,0,0,0,0|1,0,0]=3 4386 B14R1.598 C=COC(=O)COc1cnccc1Cl 34a_100011996695_100000036128 [1,1,0,0,0,0|1,0,0]=3 4387 B14R1.598 C=COC(=O)COc1cnccc1I 34a_100000050107_100000036128 [1,1,0,0,0,0|1,0,0]=3 4388 B14R1.598 C=COC(=O)COc1cnccc1N 34a_100000753702_100000036128 [1,1,0,0,0,0|1,0,0]=3 4389 B14R1.598 C=COC(=O)COc1coccc1=O 34a_100000060831_100000036128 [1,1,0,0,0,0|1,0,0]=3 4390 B14R1.598 C=COC(=O)COc1ncccc1Cl 34a_100011290957_100000036128 [1,1,0,0,0,0|1,0,0]=3 4391 B14R1.598 C=COC(=O)COc1ncccc1F 34a_100011219419_100000036128 [1,1,0,0,0,0|1,0,0]=3 4392 B14R1.598 C=COC(=O)COc1ncccc1N 34a_100000746358_100000036128 [1,1,0,0,0,0|1,0,0]=3 4393 B14R1.598 C=COC(=O)COc1nccnc1C 34a_100000766352_100000036128 [1,1,0,0,0,0|2,0,0]=4 4394 B14R1.598 C=COC(=O)CSc1c[nH]ccc1=O 62a_100000036128_100009998708 [1,1,0,0,0,0|1,1,0]=4 4395 B14R1.598 C=COC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000036128 [1,1,0,0,0,0|1,1,0]=4 4396 B14R1.598 C=COC(=O)CSc1c[nH]ccc1=S 62a_100000036128_200012280681 [1,1,0,0,0,0|1,1,0]=4 4397 B14R1.598 C=COC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000036128 [1,1,0,0,0,0|1,1,0]=4 4398 B14R1.598 C=COC(=O)CSc1cccc[n+]1C 62a_100000036128_100000212160 [1,1,0,0,0,0|1,1,0]=4 4399 B14R1.598 C=COC(=O)CSc1cccc[n+]1[O-] 62a_100000036128_200000042595 [1,1,0,0,0,0|1,1,0]=4 4400 B14R1.598 C=COC(=O)CSc1ccccc1Br 62a_100000036128_100000695589 [1,1,0,0,0,0|0,1,0]=3 4401 B14R1.598 C=COC(=O)CSc1ccccc1Br 62a_100000695589_100000036128 [1,1,0,0,0,0|0,1,0]=3 4402 B14R1.598 C=COC(=O)CSc1ccccc1C 62a_100000036128_100000210755 [1,1,0,0,0,0|0,1,0]=3 4403 B14R1.598 C=COC(=O)CSc1ccccc1C 62a_100000210755_100000036128 [1,1,0,0,0,0|0,1,0]=3 4404 B14R1.598 C=COC(=O)CSc1ccccc1Cl 62a_100000036128_100000764095 [1,1,0,0,0,0|0,1,0]=3 4405 B14R1.598 C=COC(=O)CSc1ccccc1Cl 62a_100000764095_100000036128 [1,1,0,0,0,0|0,1,0]=3 4406 B14R1.598 C=COC(=O)CSc1ccccc1F 62a_100000036128_100011215700 [1,1,0,0,0,0|0,1,0]=3 4407 B14R1.598 C=COC(=O)CSc1ccccc1F 62a_100011215700_100000036128 [1,1,0,0,0,0|0,1,0]=3 4408 B14R1.598 C=COC(=O)CSc1ccccc1N 62a_100000036128_100000210017 [1,1,0,0,0,0|0,1,0]=3 4409 B14R1.598 C=COC(=O)CSc1ccccc1N 62a_100000210017_100000036128 [1,1,0,0,0,0|0,1,0]=3 4410 B14R1.598 C=COC(=O)CSc1ccccc1O 62a_100000036128_100000739446 [1,1,0,0,0,0|0,1,0]=3 4411 B14R1.598 C=COC(=O)CSc1ccccc1O 62a_100000739446_100000036128 [1,1,0,0,0,0|0,1,0]=3 4412 B14R1.598 C=COC(=O)CSc1cccnc1Br 62a_100000036128_100010202626 [1,1,0,0,0,0|1,1,0]=4 4413 B14R1.598 C=COC(=O)CSc1cccnc1Br 62a_100010202626_100000036128 [1,1,0,0,0,0|1,1,0]=4 4414 B14R1.598 C=COC(=O)CSc1cccnc1C 62a_100000036128_100000751574 [1,1,0,0,0,0|1,1,0]=4 4415 B14R1.598 C=COC(=O)CSc1cccnc1C 62a_100000751574_100000036128 [1,1,0,0,0,0|1,1,0]=4 4416 B14R1.598 C=COC(=O)CSc1cccnc1Cl 62a_100000036128_100000036424 [1,1,0,0,0,0|1,1,0]=4 4417 B14R1.598 C=COC(=O)CSc1cccnc1Cl 62a_100000036424_100000036128 [1,1,0,0,0,0|1,1,0]=4 4418 B14R1.598 C=COC(=O)CSc1cccnc1F 62a_100000036128_100009816115 [1,1,0,0,0,0|1,1,0]=4 4419 B14R1.598 C=COC(=O)CSc1cccnc1F 62a_100009816115_100000036128 [1,1,0,0,0,0|1,1,0]=4 4420 B14R1.598 C=COC(=O)CSc1cccnc1N 62a_100000036128_100000045569 [1,1,0,0,0,0|1,1,0]=4 4421 B14R1.598 C=COC(=O)CSc1cccnc1N 62a_100000045569_100000036128 [1,1,0,0,0,0|1,1,0]=4 4422 B14R1.598 C=COC(=O)CSc1cccnc1O 62a_100000036128_100000760158 [1,1,0,0,0,0|1,1,0]=4 4423 B14R1.598 C=COC(=O)CSc1cccnc1O 62a_100000760158_100000036128 [1,1,0,0,0,0|1,1,0]=4 4424 B14R1.598 C=COC(=O)CSc1ccncc1Br 62a_100000036128_100000726257 [1,1,0,0,0,0|1,1,0]=4 4425 B14R1.598 C=COC(=O)CSc1ccncc1Br 62a_100000726257_100000036128 [1,1,0,0,0,0|1,1,0]=4 4426 B14R1.598 C=COC(=O)CSc1ccncc1C 62a_100000036128_100000765111 [1,1,0,0,0,0|1,1,0]=4 4427 B14R1.598 C=COC(=O)CSc1ccncc1C 62a_100000765111_100000036128 [1,1,0,0,0,0|1,1,0]=4 4428 B14R1.598 C=COC(=O)CSc1ccncc1Cl 62a_100000036128_100000708259 [1,1,0,0,0,0|1,1,0]=4 4429 B14R1.598 C=COC(=O)CSc1ccncc1Cl 62a_100000708259_100000036128 [1,1,0,0,0,0|1,1,0]=4 4430 B14R1.598 C=COC(=O)CSc1ccncc1F 62a_100000036128_100000047030 [1,1,0,0,0,0|1,1,0]=4 4431 B14R1.598 C=COC(=O)CSc1ccncc1F 62a_100000047030_100000036128 [1,1,0,0,0,0|1,1,0]=4 4432 B14R1.598 C=COC(=O)CSc1ccncc1N 62a_100000036128_100000756074 [1,1,0,0,0,0|1,1,0]=4 4433 B14R1.598 C=COC(=O)CSc1ccncc1N 62a_100000756074_100000036128 [1,1,0,0,0,0|1,1,0]=4 4434 B14R1.598 C=COC(=O)CSc1ccncc1O 62a_100000036128_100009817591 [1,1,0,0,0,0|1,1,0]=4 4435 B14R1.598 C=COC(=O)CSc1ccncc1O 62a_100009817591_100000036128 [1,1,0,0,0,0|1,1,0]=4 4436 B14R1.598 C=COC(=O)CSc1cnccc1Br 62a_100000036128_100010138639 [1,1,0,0,0,0|1,1,0]=4 4437 B14R1.598 C=COC(=O)CSc1cnccc1Br 62a_100010138639_100000036128 [1,1,0,0,0,0|1,1,0]=4 4438 B14R1.598 C=COC(=O)CSc1cnccc1C 62a_100000036128_100000761580 [1,1,0,0,0,0|1,1,0]=4 4439 B14R1.598 C=COC(=O)CSc1cnccc1C 62a_100000761580_100000036128 [1,1,0,0,0,0|1,1,0]=4 4440 B14R1.598 C=COC(=O)CSc1cnccc1Cl 62a_100000036128_100009995489 [1,1,0,0,0,0|1,1,0]=4 4441 B14R1.598 C=COC(=O)CSc1cnccc1Cl 62a_100009995489_100000036128 [1,1,0,0,0,0|1,1,0]=4 4442 B14R1.598 C=COC(=O)CSc1cnccc1F 62a_100000036128_100009820683 [1,1,0,0,0,0|1,1,0]=4 4443 B14R1.598 C=COC(=O)CSc1cnccc1F 62a_100009820683_100000036128 [1,1,0,0,0,0|1,1,0]=4 4444 B14R1.598 C=COC(=O)CSc1cnccc1N 62a_100000036128_100000047001 [1,1,0,0,0,0|1,1,0]=4 4445 B14R1.598 C=COC(=O)CSc1cnccc1N 62a_100000047001_100000036128 [1,1,0,0,0,0|1,1,0]=4 4446 B14R1.598 C=COC(=O)CSc1ncccc1Br 62a_100000036128_100000696092 [1,1,0,0,0,0|1,1,0]=4 4447 B14R1.598 C=COC(=O)CSc1ncccc1Br 62a_100000696092_100000036128 [1,1,0,0,0,0|1,1,0]=4 4448 B14R1.598 C=COC(=O)CSc1ncccc1C 62a_100000036128_100000751373 [1,1,0,0,0,0|1,1,0]=4 4449 B14R1.598 C=COC(=O)CSc1ncccc1C 62a_100000751373_100000036128 [1,1,0,0,0,0|1,1,0]=4 4450 B14R1.598 C=COC(=O)CSc1ncccc1Cl 62a_100000036128_100011356963 [1,1,0,0,0,0|1,1,0]=4 4451 B14R1.598 C=COC(=O)CSc1ncccc1Cl 62a_100011356963_100000036128 [1,1,0,0,0,0|1,1,0]=4 4452 B14R1.598 C=COC(=O)CSc1ncccc1F 62a_100000036128_100000685392 [1,1,0,0,0,0|1,1,0]=4 4453 B14R1.598 C=COC(=O)CSc1ncccc1F 62a_100000685392_100000036128 [1,1,0,0,0,0|1,1,0]=4 4454 B14R1.598 C=COC(=O)CSc1ncccc1N 62a_100000036128_100000688686 [1,1,0,0,0,0|1,1,0]=4 4455 B14R1.598 C=COC(=O)CSc1ncccc1N 62a_100000688686_100000036128 [1,1,0,0,0,0|1,1,0]=4 4456 B14R1.598 C=COC(=O)CSc1ncccc1O 62a_100000034122_100000036128 [1,1,0,0,0,0|1,1,0]=4 4457 B14R1.598 C=COC(=O)CSc1ncccc1O 62a_100000036128_100000034122 [1,1,0,0,0,0|1,1,0]=4 4458 B14R1.598 CCCC(=O)COc1ccccc1Br 1458a_100000216496_100000210303 [1,1,0,0,0,0|0,0,2]=4 4459 B14R1.598 CCCC(=O)COc1ccccc1Br 7a_100000181306_100000747444 [1,1,0,0,0,0|0,0,2]=4 4460 B14R1.598 CCCC(=O)COc1ccccc1C 1458a_100000182418_100000210303 [1,1,0,0,0,0|0,0,2]=4 4461 B14R1.598 CCCC(=O)COc1ccccc1C 7a_100000210338_100000747444 [1,1,0,0,0,0|0,0,2]=4 4462 B14R1.598 CCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210303 [1,1,0,0,0,0|0,0,2]=4 4463 B14R1.598 CCCC(=O)COc1ccccc1Cl 7a_100000210172_100000747444 [1,1,0,0,0,0|0,0,2]=4 4464 B14R1.598 CCCC(=O)COc1ccccc1F 1458a_100000182486_100000210303 [1,1,0,0,0,0|0,0,2]=4 4465 B14R1.598 CCCC(=O)COc1ccccc1F 7a_100000210171_100000747444 [1,1,0,0,0,0|0,0,2]=4 4466 B14R1.598 CCCC(=O)COc1ccccc1I 7a_100000739446_100000747444 [1,1,0,0,0,0|0,0,2]=4 4467 B14R1.598 CCCC(=O)COc1ccccc1N 7a_100000185747_100000747444 [1,1,0,0,0,0|0,0,2]=4 4468 B14R1.598 CCCC(=O)COc1ccccc1O 1458a_100000183020_100000210303 [1,1,0,0,0,0|0,0,2]=4 4469 B14R1.598 CCNC(=O)COc1ccccc1Br 11a_100015525214_100000216496 [1,1,0,0,0,0|1,0,1]=4 4470 B14R1.598 CCNC(=O)COc1ccccc1Br 240690a_100015525214_100000216496 [1,1,0,0,0,0|1,0,1]=4 4471 B14R1.598 CCNC(=O)COc1ccccc1Br 34a_100000181306_100000183381 [1,1,0,0,0,0|1,0,1]=4 4472 B14R1.598 CCNC(=O)COc1ccccc1Br 527a_100015525214_100000216496 [1,1,0,0,0,0|1,0,1]=4 4473 B14R1.598 CCNC(=O)COc1ccccc1Br 7a_100000181306_100000183381 [1,1,0,0,0,0|1,0,1]=4 4474 B14R1.598 CCNC(=O)COc1ccccc1C 11a_100015525214_100000182418 [1,1,0,0,0,0|1,0,1]=4 4475 B14R1.598 CCNC(=O)COc1ccccc1C 240690a_100015525214_100000182418 [1,1,0,0,0,0|1,0,1]=4 4476 B14R1.598 CCNC(=O)COc1ccccc1C 34a_100000210338_100000183381 [1,1,0,0,0,0|1,0,1]=4 4477 B14R1.598 CCNC(=O)COc1ccccc1C 527a_100015525214_100000182418 [1,1,0,0,0,0|1,0,1]=4 4478 B14R1.598 CCNC(=O)COc1ccccc1C 7a_100000210338_100000183381 [1,1,0,0,0,0|1,0,1]=4 4479 B14R1.598 CCNC(=O)COc1ccccc1Cl 11a_100015525214_100000185159 [1,1,0,0,0,0|1,0,1]=4 4480 B14R1.598 CCNC(=O)COc1ccccc1Cl 240690a_100015525214_100000185159 [1,1,0,0,0,0|1,0,1]=4 4481 B14R1.598 CCNC(=O)COc1ccccc1Cl 34a_100000210172_100000183381 [1,1,0,0,0,0|1,0,1]=4 4482 B14R1.598 CCNC(=O)COc1ccccc1Cl 527a_100015525214_100000185159 [1,1,0,0,0,0|1,0,1]=4 4483 B14R1.598 CCNC(=O)COc1ccccc1Cl 7a_100000210172_100000183381 [1,1,0,0,0,0|1,0,1]=4 4484 B14R1.598 CCNC(=O)COc1ccccc1F 11a_100015525214_100000182486 [1,1,0,0,0,0|1,0,1]=4 4485 B14R1.598 CCNC(=O)COc1ccccc1F 240690a_100015525214_100000182486 [1,1,0,0,0,0|1,0,1]=4 4486 B14R1.598 CCNC(=O)COc1ccccc1F 34a_100000210171_100000183381 [1,1,0,0,0,0|1,0,1]=4 4487 B14R1.598 CCNC(=O)COc1ccccc1F 527a_100015525214_100000182486 [1,1,0,0,0,0|1,0,1]=4 4488 B14R1.598 CCNC(=O)COc1ccccc1F 7a_100000210171_100000183381 [1,1,0,0,0,0|1,0,1]=4 4489 B14R1.598 CCNC(=O)COc1ccccc1I 34a_100000739446_100000183381 [1,1,0,0,0,0|1,0,1]=4 4490 B14R1.598 CCNC(=O)COc1ccccc1I 7a_100000739446_100000183381 [1,1,0,0,0,0|1,0,1]=4 4491 B14R1.598 CCNC(=O)COc1ccccc1N 34a_100000185747_100000183381 [1,1,0,0,0,0|1,0,1]=4 4492 B14R1.598 CCNC(=O)COc1ccccc1N 7a_100000185747_100000183381 [1,1,0,0,0,0|1,0,1]=4 4493 B14R1.598 CCNC(=O)COc1ccccc1O 240690a_100015525214_100000183020 [1,1,0,0,0,0|1,0,1]=4 4494 B14R1.598 CCNC(=O)COc1ccccc1O 527a_100015525214_100000183020 [1,1,0,0,0,0|1,0,1]=4 4495 B14R1.598 CCOC(=O)CCc1ccccc1O 271570a_203496583355_100009815309 [1,1,0,0,0,0|1,0,1]=4 4496 B14R1.598 CCOC(=O)CNc1ccccc1Br 34a_100000210017_100000188475 [1,1,0,0,0,0|1,0,1]=4 4497 B14R1.598 CCOC(=O)CNc1ccccc1C 34a_100015192222_100000188475 [1,1,0,0,0,0|1,0,1]=4 4498 B14R1.598 CCOC(=O)CNc1ccccc1Cl 34a_100000185783_100000188475 [1,1,0,0,0,0|1,0,1]=4 4499 B14R1.598 CCOC(=O)CNc1ccccc1F 34a_100000210422_100000188475 [1,1,0,0,0,0|1,0,1]=4 4500 B14R1.598 CCOC(=O)CNc1ccccc1I 34a_100000210053_100000188475 [1,1,0,0,0,0|1,0,1]=4 4501 B14R1.598 CCOC(=O)CNc1ccccc1O 34a_100000185747_100000188475 [1,1,0,0,0,0|1,0,1]=4 4502 B14R1.598 CCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000188475 [1,1,0,0,0,0|1,0,1]=4 4503 B14R1.598 CCOC(=O)COc1ccccc1Br 34a_100000181306_100000188475 [1,1,0,0,0,0|0,0,1]=3 4504 B14R1.598 CCOC(=O)COc1ccccc1Br 7a_100000181306_100000188475 [1,1,0,0,0,0|0,0,1]=3 4505 B14R1.598 CCOC(=O)COc1ccccc1C 34a_100000210338_100000188475 [1,1,0,0,0,0|0,0,1]=3 4506 B14R1.598 CCOC(=O)COc1ccccc1C 7a_100000210338_100000188475 [1,1,0,0,0,0|0,0,1]=3 4507 B14R1.598 CCOC(=O)COc1ccccc1Cl 34a_100000210172_100000188475 [1,1,0,0,0,0|0,0,1]=3 4508 B14R1.598 CCOC(=O)COc1ccccc1Cl 7a_100000210172_100000188475 [1,1,0,0,0,0|0,0,1]=3 4509 B14R1.598 CCOC(=O)COc1ccccc1F 34a_100000210171_100000188475 [1,1,0,0,0,0|0,0,1]=3 4510 B14R1.598 CCOC(=O)COc1ccccc1F 7a_100000210171_100000188475 [1,1,0,0,0,0|0,0,1]=3 4511 B14R1.598 CCOC(=O)COc1ccccc1I 34a_100000739446_100000188475 [1,1,0,0,0,0|0,0,1]=3 4512 B14R1.598 CCOC(=O)COc1ccccc1I 7a_100000739446_100000188475 [1,1,0,0,0,0|0,0,1]=3 4513 B14R1.598 CCOC(=O)COc1ccccc1N 34a_100000185747_100000188475 [1,1,0,0,0,0|0,0,1]=3 4514 B14R1.598 CCOC(=O)COc1ccccc1N 7a_100000185747_100000188475 [1,1,0,0,0,0|0,0,1]=3 4515 B14R1.598 CCOC(=O)COc1ccccc1O 271570a_203496583355_100000174061 [1,1,0,0,0,0|0,0,1]=3 4516 B14R1.598 CCOC(=O)COc1cccnc1Br 34a_100000744436_100000188475 [1,1,0,0,0,0|1,0,1]=4 4517 B14R1.598 CCOC(=O)COc1cccnc1Br 7a_100000744436_100000188475 [1,1,0,0,0,0|1,0,1]=4 4518 B14R1.598 CCOC(=O)COc1cccnc1C 34a_100000745507_100000188475 [1,1,0,0,0,0|1,0,1]=4 4519 B14R1.598 CCOC(=O)COc1cccnc1C 7a_100000745507_100000188475 [1,1,0,0,0,0|1,0,1]=4 4520 B14R1.598 CCOC(=O)COc1cccnc1Cl 34a_100000757616_100000188475 [1,1,0,0,0,0|1,0,1]=4 4521 B14R1.598 CCOC(=O)COc1cccnc1Cl 7a_100000757616_100000188475 [1,1,0,0,0,0|1,0,1]=4 4522 B14R1.598 CCOC(=O)COc1cccnc1F 34a_100000061740_100000188475 [1,1,0,0,0,0|1,0,1]=4 4523 B14R1.598 CCOC(=O)COc1cccnc1F 7a_100000061740_100000188475 [1,1,0,0,0,0|1,0,1]=4 4524 B14R1.598 CCOC(=O)COc1cccnc1I 34a_100000034122_100000188475 [1,1,0,0,0,0|1,0,1]=4 4525 B14R1.598 CCOC(=O)COc1cccnc1I 7a_100000034122_100000188475 [1,1,0,0,0,0|1,0,1]=4 4526 B14R1.598 CCOC(=O)COc1cccnc1N 34a_100000211975_100000188475 [1,1,0,0,0,0|1,0,1]=4 4527 B14R1.598 CCOC(=O)COc1cccnc1N 7a_100000211975_100000188475 [1,1,0,0,0,0|1,0,1]=4 4528 B14R1.598 CCOC(=O)COc1cccoc1=O 34a_100000077404_100000188475 [1,1,0,0,0,0|1,0,1]=4 4529 B14R1.598 CCOC(=O)COc1cccoc1=O 7a_100000077404_100000188475 [1,1,0,0,0,0|1,0,1]=4 4530 B14R1.598 CCOC(=O)COc1ccncc1Br 34a_100011996408_100000188475 [1,1,0,0,0,0|1,0,1]=4 4531 B14R1.598 CCOC(=O)COc1ccncc1C 34a_100000694293_100000188475 [1,1,0,0,0,0|1,0,1]=4 4532 B14R1.598 CCOC(=O)COc1ccncc1Cl 34a_100011997054_100000188475 [1,1,0,0,0,0|1,0,1]=4 4533 B14R1.598 CCOC(=O)COc1ccncc1F 34a_200000081243_100000188475 [1,1,0,0,0,0|1,0,1]=4 4534 B14R1.598 CCOC(=O)COc1cnccc1C 34a_100011997053_100000188475 [1,1,0,0,0,0|1,0,1]=4 4535 B14R1.598 CCOC(=O)COc1cnccc1C 7a_100011997053_100000188475 [1,1,0,0,0,0|1,0,1]=4 4536 B14R1.598 CCOC(=O)COc1cnccc1Cl 34a_100011996695_100000188475 [1,1,0,0,0,0|1,0,1]=4 4537 B14R1.598 CCOC(=O)COc1cnccc1I 34a_100000050107_100000188475 [1,1,0,0,0,0|1,0,1]=4 4538 B14R1.598 CCOC(=O)COc1cnccc1N 34a_100000753702_100000188475 [1,1,0,0,0,0|1,0,1]=4 4539 B14R1.598 CCOC(=O)COc1coccc1=O 34a_100000060831_100000188475 [1,1,0,0,0,0|1,0,1]=4 4540 B14R1.598 CCOC(=O)COc1ncccc1Cl 34a_100011290957_100000188475 [1,1,0,0,0,0|1,0,1]=4 4541 B14R1.598 CCOC(=O)COc1ncccc1F 34a_100011219419_100000188475 [1,1,0,0,0,0|1,0,1]=4 4542 B14R1.598 CCOC(=O)COc1ncccc1N 34a_100000746358_100000188475 [1,1,0,0,0,0|1,0,1]=4 4543 B14R1.598 CCOC(=O)CSc1ccccc1Br 62a_100000188475_100000695589 [1,1,0,0,0,0|0,1,1]=4 4544 B14R1.598 CCOC(=O)CSc1ccccc1Br 62a_100000695589_100000188475 [1,1,0,0,0,0|0,1,1]=4 4545 B14R1.598 CCOC(=O)CSc1ccccc1C 62a_100000188475_100000210755 [1,1,0,0,0,0|0,1,1]=4 4546 B14R1.598 CCOC(=O)CSc1ccccc1C 62a_100000210755_100000188475 [1,1,0,0,0,0|0,1,1]=4 4547 B14R1.598 CCOC(=O)CSc1ccccc1Cl 62a_100000188475_100000764095 [1,1,0,0,0,0|0,1,1]=4 4548 B14R1.598 CCOC(=O)CSc1ccccc1Cl 62a_100000764095_100000188475 [1,1,0,0,0,0|0,1,1]=4 4549 B14R1.598 CCOC(=O)CSc1ccccc1F 62a_100000188475_100011215700 [1,1,0,0,0,0|0,1,1]=4 4550 B14R1.598 CCOC(=O)CSc1ccccc1F 62a_100011215700_100000188475 [1,1,0,0,0,0|0,1,1]=4 4551 B14R1.598 CCOC(=O)CSc1ccccc1N 62a_100000188475_100000210017 [1,1,0,0,0,0|0,1,1]=4 4552 B14R1.598 CCOC(=O)CSc1ccccc1N 62a_100000210017_100000188475 [1,1,0,0,0,0|0,1,1]=4 4553 B14R1.598 CCOC(=O)CSc1ccccc1O 62a_100000188475_100000739446 [1,1,0,0,0,0|0,1,1]=4 4554 B14R1.598 CCOC(=O)CSc1ccccc1O 62a_100000739446_100000188475 [1,1,0,0,0,0|0,1,1]=4 4555 B14R1.598 Cc1ccccc1OCC(=O)CC#N 1458a_100000182418_100011214920 [1,1,0,0,0,0|1,0,1]=4 4556 B14R1.598 Cc1ccccc1OCC(=O)CCF 1458a_100000182418_100011217306 [1,1,0,0,0,0|1,0,1]=4 4557 B14R1.598 Cc1ccccc1OCC(=O)CCO 1458a_100000182418_100000211926 [1,1,0,0,0,0|1,0,1]=4 4558 B14R1.598 Cc1ccccc1OCC(=O)NCO 34a_100000210338_100000185155 [1,1,0,0,0,0|2,0,0]=4 4559 B14R1.598 Cc1ccccc1OCC(=O)NCO 7a_100000210338_100000185155 [1,1,0,0,0,0|2,0,0]=4 4560 B14R1.598 N#CCC(=O)COc1ccccc1Br 1458a_100000216496_100011214920 [1,1,0,0,0,0|1,0,1]=4 4561 B14R1.598 N#CCC(=O)COc1ccccc1Cl 1458a_100000185159_100011214920 [1,1,0,0,0,0|1,0,1]=4 4562 B14R1.598 N#CCC(=O)COc1ccccc1F 1458a_100000182486_100011214920 [1,1,0,0,0,0|1,0,1]=4 4563 B14R1.598 N#CCC(=O)COc1ccccc1O 1458a_100000183020_100011214920 [1,1,0,0,0,0|1,0,1]=4 4564 B14R1.598 Nc1ccccc1OCC(=O)NCO 34a_100000185747_100000185155 [1,1,0,0,0,0|2,0,0]=4 4565 B14R1.598 Nc1ccccc1OCC(=O)NCO 7a_100000185747_100000185155 [1,1,0,0,0,0|2,0,0]=4 4566 B14R1.598 O=C(CCF)COc1ccccc1Br 1458a_100000216496_100011217306 [1,1,0,0,0,0|1,0,1]=4 4567 B14R1.598 O=C(CCF)COc1ccccc1Cl 1458a_100000185159_100011217306 [1,1,0,0,0,0|1,0,1]=4 4568 B14R1.598 O=C(CCF)COc1ccccc1F 1458a_100000182486_100011217306 [1,1,0,0,0,0|1,0,1]=4 4569 B14R1.598 O=C(CCF)COc1ccccc1O 1458a_100000183020_100011217306 [1,1,0,0,0,0|1,0,1]=4 4570 B14R1.598 O=C(CCO)COc1ccccc1Br 1458a_100000216496_100000211926 [1,1,0,0,0,0|1,0,1]=4 4571 B14R1.598 O=C(CCO)COc1ccccc1Cl 1458a_100000185159_100000211926 [1,1,0,0,0,0|1,0,1]=4 4572 B14R1.598 O=C(CCO)COc1ccccc1F 1458a_100000182486_100000211926 [1,1,0,0,0,0|1,0,1]=4 4573 B14R1.598 O=C(CCO)COc1ccccc1O 1458a_100000183020_100000211926 [1,1,0,0,0,0|1,0,1]=4 4574 B14R1.598 O=C(COc1ccccc1Br)NCO 34a_100000181306_100000185155 [1,1,0,0,0,0|2,0,0]=4 4575 B14R1.598 O=C(COc1ccccc1Br)NCO 7a_100000181306_100000185155 [1,1,0,0,0,0|2,0,0]=4 4576 B14R1.598 O=C(COc1ccccc1Cl)NCO 34a_100000210172_100000185155 [1,1,0,0,0,0|2,0,0]=4 4577 B14R1.598 O=C(COc1ccccc1Cl)NCO 7a_100000210172_100000185155 [1,1,0,0,0,0|2,0,0]=4 4578 B14R1.598 O=C(COc1ccccc1F)NCO 34a_100000210171_100000185155 [1,1,0,0,0,0|2,0,0]=4 4579 B14R1.598 O=C(COc1ccccc1F)NCO 7a_100000210171_100000185155 [1,1,0,0,0,0|2,0,0]=4 4580 B14R1.598 O=C(COc1ccccc1I)NCO 34a_100000739446_100000185155 [1,1,0,0,0,0|2,0,0]=4 4581 B14R1.598 O=C(COc1ccccc1I)NCO 7a_100000739446_100000185155 [1,1,0,0,0,0|2,0,0]=4 4582 B14R1.756 C#CC(C)C(=O)COc1ccccc1 1458a_100000186222_200000035995 [1,1,0,0,0,0|0,0,2]=4 4583 B14R1.756 C=CC(C)C(=O)CCc1ccccc1 1458a_100011216780_100000765856 [1,1,0,0,0,0|1,0,0]=3 4584 B14R1.756 C=CC(C)C(=O)CCc1ccccn1 1458a_100011216780_100015183660 [1,1,0,0,0,0|2,0,0]=4 4585 B14R1.756 C=CC(C)C(=O)CCc1cccnc1 1458a_100011216780_200011713674 [1,1,0,0,0,0|2,0,0]=4 4586 B14R1.756 C=CC(C)C(=O)CCc1ccncc1 1458a_100011216780_100000723409 [1,1,0,0,0,0|2,0,0]=4 4587 B14R1.756 C=CC(C)C(=O)NCc1ccccc1 11a_100015324214_100011216780 [1,1,0,0,0,0|2,0,0]=4 4588 B14R1.756 C=CC(C)C(=O)NCc1ccccc1 1626a_100015324214_100011216780 [1,1,0,0,0,0|2,0,0]=4 4589 B14R1.756 C=CC(C)C(=O)NCc1ccccc1 240690a_100015324214_100011216780 [1,1,0,0,0,0|2,0,0]=4 4590 B14R1.756 C=CC(C)C(=O)NCc1ccccc1 527a_100015324214_100011216780 [1,1,0,0,0,0|2,0,0]=4 4591 B14R1.756 C=CC(C)C(=O)NNc1ccccc1 22a_100015195140_100011216780 [1,1,0,0,0,0|2,0,0]=4 4592 B14R1.756 CC(C#N)C(=O)COc1ccccc1 1458a_100000186222_100000703298 [1,1,0,0,0,0|1,0,1]=4 4593 B14R1.756 CCC(C)C(=O)COc1ccccc1 1458a_100000186222_100000758301 [1,1,0,0,0,0|0,0,2]=4 4594 B14R1.756 CCN(C)C(=O)COc1ccccc1 11a_100000225621_100000186222 [1,1,0,0,0,0|1,0,1]=4 4595 B14R1.756 CCN(C)C(=O)COc1ccccc1 1626a_100000225621_100000186222 [1,1,0,0,0,0|1,0,1]=4 4596 B14R1.756 CCN(C)C(=O)COc1ccccc1 240690a_100000225621_100000186222 [1,1,0,0,0,0|1,0,1]=4 4597 B14R1.756 CCN(C)C(=O)COc1ccccc1 34a_100000210340_100000738999 [1,1,0,0,0,0|1,0,1]=4 4598 B14R1.756 CCN(C)C(=O)COc1ccccc1 527a_100000225621_100000186222 [1,1,0,0,0,0|1,0,1]=4 4599 B14R1.756 CCN(C)C(=O)COc1ccccc1 7a_100000210340_100000738999 [1,1,0,0,0,0|1,0,1]=4 4600 B14R1.818 C=C(C)CC(=O)C#Cc1ccccc1 1458a_100000736102_100000748629 [1,1,0,0,0,0|1,0,1]=4 4601 B14R1.818 C=C(C)CC(=O)C=Cc1ccccc1 1458a_100000210462_100000748629 [1,1,0,0,0,0|1,0,1]=4 4602 B14R1.818 C=C(C)CC(=O)CCc1ccccc1 1458a_100000185753_100000748629 [1,1,0,0,0,0|1,0,0]=3 4603 B14R1.818 C=C(C)CC(=O)CCc1ccccn1 1458a_100015195070_100000748629 [1,1,0,0,0,0|2,0,0]=4 4604 B14R1.818 C=C(C)CC(=O)CCc1cccnc1 1458a_100000198484_100000748629 [1,1,0,0,0,0|2,0,0]=4 4605 B14R1.818 C=C(C)CC(=O)CCc1ccncc1 1458a_100011225043_100000748629 [1,1,0,0,0,0|2,0,0]=4 4606 B14R1.818 C=C(C)CC(=O)COc1ccccc1 1458a_100000186222_100000748629 [1,1,0,0,0,0|0,0,0]=2 4607 B14R1.818 C=C(C)CC(=O)COc1ccccn1 1458a_100102699861_100000748629 [1,1,0,0,0,0|1,0,0]=3 4608 B14R1.818 C=C(C)CC(=O)COc1cccnc1 1458a_100015207166_100000748629 [1,1,0,0,0,0|1,0,0]=3 4609 B14R1.818 C=C(C)CC(=O)CSc1ccccc1 1458a_100000211596_100000748629 [1,1,0,0,0,0|0,1,0]=3 4610 B14R1.818 C=C(C)CC(=O)CSc1ccccn1 1458a_100000156281_100000748629 [1,1,0,0,0,0|1,1,0]=4 4611 B14R1.818 C=C(C)CC(=O)CSc1ccncc1 1458a_100000211328_100000748629 [1,1,0,0,0,0|1,1,0]=4 4612 B14R1.818 C=C(F)CC(=O)C#Cc1ccccc1 1458a_100000736102_100009893438 [1,1,0,0,0,0|1,0,1]=4 4613 B14R1.818 C=C(F)CC(=O)C=Cc1ccccc1 1458a_100000210462_100009893438 [1,1,0,0,0,0|1,0,1]=4 4614 B14R1.818 C=C(F)CC(=O)CCc1ccccc1 1458a_100000185753_100009893438 [1,1,0,0,0,0|1,0,0]=3 4615 B14R1.818 C=C(F)CC(=O)CCc1ccccn1 1458a_100015195070_100009893438 [1,1,0,0,0,0|2,0,0]=4 4616 B14R1.818 C=C(F)CC(=O)CCc1cccnc1 1458a_100000198484_100009893438 [1,1,0,0,0,0|2,0,0]=4 4617 B14R1.818 C=C(F)CC(=O)CCc1ccncc1 1458a_100011225043_100009893438 [1,1,0,0,0,0|2,0,0]=4 4618 B14R1.818 C=C(F)CC(=O)COc1ccccc1 1458a_100000186222_100009893438 [1,1,0,0,0,0|0,0,0]=2 4619 B14R1.818 C=C(F)CC(=O)COc1ccccn1 1458a_100102699861_100009893438 [1,1,0,0,0,0|1,0,0]=3 4620 B14R1.818 C=C(F)CC(=O)COc1cccnc1 1458a_100015207166_100009893438 [1,1,0,0,0,0|1,0,0]=3 4621 B14R1.818 C=C(F)CC(=O)CSc1ccccc1 1458a_100000211596_100009893438 [1,1,0,0,0,0|0,1,0]=3 4622 B14R1.818 C=C(F)CC(=O)CSc1ccccn1 1458a_100000156281_100009893438 [1,1,0,0,0,0|1,1,0]=4 4623 B14R1.818 C=C(F)CC(=O)CSc1ccncc1 1458a_100000211328_100009893438 [1,1,0,0,0,0|1,1,0]=4 4624 B14R1.818 CC(=O)CC(=O)CCc1ccccc1 1458a_100000070787_100012361361 [1,1,0,0,0,0|1,0,1]=4 4625 B14R1.818 CC(=O)NC(=O)COc1ccccc1 7a_100000210340_100000183797 [1,1,0,0,0,0|1,0,1]=4 4626 B14R1.818 CC(C)CC(=O)COc1ccccc1 1458a_100000186222_100000210624 [1,1,0,0,0,0|0,0,2]=4 4627 B14R1.818 CC(C)NC(=O)COc1ccccc1 11a_100138425928_100000186222 [1,1,0,0,0,0|1,0,1]=4 4628 B14R1.818 CC(C)NC(=O)COc1ccccc1 1626a_100138425928_100000186222 [1,1,0,0,0,0|1,0,1]=4 4629 B14R1.818 CC(C)NC(=O)COc1ccccc1 240690a_100138425928_100000186222 [1,1,0,0,0,0|1,0,1]=4 4630 B14R1.818 CC(C)NC(=O)COc1ccccc1 34a_100000210340_100000183996 [1,1,0,0,0,0|1,0,1]=4 4631 B14R1.818 CC(C)NC(=O)COc1ccccc1 527a_100138425928_100000186222 [1,1,0,0,0,0|1,0,1]=4 4632 B14R1.818 CC(C)NC(=O)COc1ccccc1 7a_100000210340_100000183996 [1,1,0,0,0,0|1,0,1]=4 4633 B14R1.818 CC(C)OC(=O)CNc1ccccc1 34a_100000106764_100011215430 [1,1,0,0,0,0|1,0,1]=4 4634 B14R1.818 CC(C)OC(=O)COc1ccccc1 34a_100000210340_100011215430 [1,1,0,0,0,0|0,0,1]=3 4635 B14R1.818 CC(C)OC(=O)COc1ccccc1 7a_100000210340_100011215430 [1,1,0,0,0,0|0,0,1]=3 4636 B14R1.818 CC(C)OC(=O)COc1cccnc1 34a_100000210849_100011215430 [1,1,0,0,0,0|1,0,1]=4 4637 B14R1.818 CC(C)OC(=O)COc1cccnc1 7a_100000210849_100011215430 [1,1,0,0,0,0|1,0,1]=4 4638 B14R1.818 CC(C)OC(=O)COc1ccncc1 34a_100000212176_100011215430 [1,1,0,0,0,0|1,0,1]=4 4639 B14R1.818 CC(C)OC(=O)CSc1ccccc1 62a_100000719477_100011215430 [1,1,0,0,0,0|0,1,1]=4 4640 B14R1.818 CC(C)OC(=O)CSc1ccccc1 62a_100011215430_100000041952 [1,1,0,0,0,0|0,1,1]=4 4641 B14R1.818 CC(O)CC(=O)COc1ccccc1 1458a_100000186222_100011218427 [1,1,0,0,0,0|0,0,2]=4 4642 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000187820 [1,1,0,0,0,0|2,0,0]=4 4643 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100134613110_100000765856 [1,1,0,0,0,0|2,0,0]=4 4644 B14R1.818 NC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000187820 [1,1,0,0,0,0|1,0,0]=3 4645 B14R1.818 NC(=O)CC(=O)COc1ccccn1 1458a_100102699861_100000187820 [1,1,0,0,0,0|2,0,0]=4 4646 B14R1.818 NC(=O)CC(=O)COc1cccnc1 1458a_100015207166_100000187820 [1,1,0,0,0,0|2,0,0]=4 4647 B14R1.818 NC(=O)CC(=O)CSc1ccccc1 1458a_100000211596_100000187820 [1,1,0,0,0,0|1,1,0]=4 4648 B14R1.818 NC(=O)NC(=O)COc1ccccc1 7a_100000210340_100000182717 [1,1,0,0,0,0|2,0,0]=4 4649 B14R1.818 O=C(COc1ccccc1)CC(F)F 1458a_100000186222_100011934356 [1,1,0,0,0,0|1,0,1]=4 4650 B14R1.818 O=C(COc1ccccc1)C[N+](=O)[O-] 1458a_100000186222_100000761209 [1,1,0,0,0,0|2,0,0]=4 4651 B14R1.818 O=C([O-])CC(=O)CCc1ccccc1 1458a_100000185753_100020667443 [1,1,0,0,0,0|2,0,0]=4 4652 B14R1.818 O=C([O-])CC(=O)COc1ccccc1 1458a_100000186222_100020667443 [1,1,0,0,0,0|1,0,0]=3 4653 B14R1.818 O=C([O-])CC(=O)COc1ccccn1 1458a_100102699861_100020667443 [1,1,0,0,0,0|2,0,0]=4 4654 B14R1.818 O=C([O-])CC(=O)COc1cccnc1 1458a_100015207166_100020667443 [1,1,0,0,0,0|2,0,0]=4 4655 B14R1.818 O=C([O-])CC(=O)CSc1ccccc1 1458a_100000211596_100020667443 [1,1,0,0,0,0|1,1,0]=4 4656 B14R1.6829 C=CC[Si](C)(C)COc1ccccc1 7a_100000210340_100000046978 [1,1,0,0,0,0|1,1,0]=4 4657 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)Br 1458a_100016291481_100000189115 [0,1,0,0,1,0|1,0,1]=4 4658 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)C 1458a_100016291481_100000210814 [0,1,0,0,1,0|1,0,1]=4 4659 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016291481_100000694040 [0,1,0,0,1,0|1,0,1]=4 4660 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)F 1458a_100016291481_100000198546 [0,1,0,0,1,0|1,0,1]=4 4661 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)I 1458a_100016291481_100000189116 [0,1,0,0,1,0|1,0,1]=4 4662 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000754431 [0,1,0,0,1,0|1,0,0]=3 4663 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Br 1458a_100000749702_100000189115 [0,1,0,0,1,0|1,0,0]=3 4664 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000754431 [0,1,0,0,1,0|1,0,0]=3 4665 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)C 1458a_100000749702_100000210814 [0,1,0,0,1,0|1,0,0]=3 4666 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000754431 [0,1,0,0,1,0|1,0,0]=3 4667 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749702_100000694040 [0,1,0,0,1,0|1,0,0]=3 4668 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000754431 [0,1,0,0,1,0|1,0,0]=3 4669 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)F 1458a_100000749702_100000198546 [0,1,0,0,1,0|1,0,0]=3 4670 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000754431 [0,1,0,0,1,0|1,0,0]=3 4671 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)I 1458a_100000749702_100000189116 [0,1,0,0,1,0|1,0,0]=3 4672 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000754431 [0,1,0,0,1,0|1,0,0]=3 4673 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)Br 1458a_100000749702_100000702658 [0,1,0,0,1,0|2,0,0]=4 4674 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000754431 [0,1,0,0,1,0|2,0,0]=4 4675 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)C 1458a_100000749702_100000691093 [0,1,0,0,1,0|2,0,0]=4 4676 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000754431 [0,1,0,0,1,0|2,0,0]=4 4677 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000754431 [0,1,0,0,1,0|2,0,0]=4 4678 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)Cl 1458a_100000749702_100012066911 [0,1,0,0,1,0|2,0,0]=4 4679 B14R1.33 C=CCCC(=O)Cc1ccc(cn1)F 1458a_100000749702_100000703193 [0,1,0,0,1,0|2,0,0]=4 4680 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)Br 1458a_100000749702_100009831999 [0,1,0,0,1,0|2,0,0]=4 4681 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000754431 [0,1,0,0,1,0|2,0,0]=4 4682 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000754431 [0,1,0,0,1,0|2,0,0]=4 4683 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)C 1458a_100000749702_100016987292 [0,1,0,0,1,0|2,0,0]=4 4684 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000754431 [0,1,0,0,1,0|2,0,0]=4 4685 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)Cl 1458a_100000749702_100000735431 [0,1,0,0,1,0|2,0,0]=4 4686 B14R1.33 C=CCCC(=O)Cc1ccc(nc1)F 1458a_100000749702_100009820150 [0,1,0,0,1,0|2,0,0]=4 4687 B14R1.33 C=CCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000754431 [0,1,0,0,1,0|2,0,0]=4 4688 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000749702 [0,1,0,0,1,0|2,0,0]=4 4689 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000749702 [0,1,0,0,1,0|2,0,0]=4 4690 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000749702 [0,1,0,0,1,0|2,0,0]=4 4691 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000749702 [0,1,0,0,1,0|2,0,0]=4 4692 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000749702 [0,1,0,0,1,0|2,0,0]=4 4693 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000749702 [0,1,0,0,1,0|2,0,0]=4 4694 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000749702 [0,1,0,0,1,0|2,0,0]=4 4695 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000749702 [0,1,0,0,1,0|2,0,0]=4 4696 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749702 [0,1,0,0,1,0|2,0,0]=4 4697 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749702 [0,1,0,0,1,0|2,0,0]=4 4698 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749702 [0,1,0,0,1,0|2,0,0]=4 4699 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749702 [0,1,0,0,1,0|2,0,0]=4 4700 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000749702 [0,1,0,0,1,0|2,0,0]=4 4701 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000749702 [0,1,0,0,1,0|2,0,0]=4 4702 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000749702 [0,1,0,0,1,0|2,0,0]=4 4703 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000749702 [0,1,0,0,1,0|2,0,0]=4 4704 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000749702 [0,1,0,0,1,0|2,0,0]=4 4705 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000749702 [0,1,0,0,1,0|2,0,0]=4 4706 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000749702 [0,1,0,0,1,0|2,0,0]=4 4707 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000749702 [0,1,0,0,1,0|2,0,0]=4 4708 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000749702 [0,1,0,0,1,0|2,0,0]=4 4709 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br 240690a_100020586998_100000198978 [0,1,0,0,1,0|1,0,0]=3 4710 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br 527a_100020586998_100000198978 [0,1,0,0,1,0|1,0,0]=3 4711 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C 240690a_100020586998_100000212244 [0,1,0,0,1,0|1,0,0]=3 4712 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C 527a_100020586998_100000212244 [0,1,0,0,1,0|1,0,0]=3 4713 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl 240690a_100020586998_100000211027 [0,1,0,0,1,0|1,0,0]=3 4714 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl 527a_100020586998_100000211027 [0,1,0,0,1,0|1,0,0]=3 4715 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 1626a_100020586998_100000210951 [0,1,0,0,1,0|1,0,0]=3 4716 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 240690a_100020586998_100000210951 [0,1,0,0,1,0|1,0,0]=3 4717 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 527a_100020586998_100000210951 [0,1,0,0,1,0|1,0,0]=3 4718 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 1626a_100020586998_100000688869 [0,1,0,0,1,0|1,0,0]=3 4719 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 240690a_100020586998_100000688869 [0,1,0,0,1,0|1,0,0]=3 4720 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 527a_100020586998_100000688869 [0,1,0,0,1,0|1,0,0]=3 4721 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 1626a_100020586998_100000198540 [0,1,0,0,1,0|1,0,0]=3 4722 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 240690a_100020586998_100000198540 [0,1,0,0,1,0|1,0,0]=3 4723 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 527a_100020586998_100000198540 [0,1,0,0,1,0|1,0,0]=3 4724 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Br 240690a_100020586998_100020629044 [0,1,0,0,1,0|2,0,0]=4 4725 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)C 1626a_100020586998_100025705728 [0,1,0,0,1,0|2,0,0]=4 4726 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)C 240690a_100020586998_100025705728 [0,1,0,0,1,0|2,0,0]=4 4727 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 1626a_100020586998_100000728320 [0,1,0,0,1,0|2,0,0]=4 4728 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 240690a_100020586998_100000728320 [0,1,0,0,1,0|2,0,0]=4 4729 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 527a_100020586998_100000728320 [0,1,0,0,1,0|2,0,0]=4 4730 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Br 240690a_100020586998_100010067268 [0,1,0,0,1,0|2,0,0]=4 4731 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Br 527a_100020586998_100010067268 [0,1,0,0,1,0|2,0,0]=4 4732 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)C 1626a_100020586998_100000740413 [0,1,0,0,1,0|2,0,0]=4 4733 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)C 240690a_100020586998_100000740413 [0,1,0,0,1,0|2,0,0]=4 4734 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)C 527a_100020586998_100000740413 [0,1,0,0,1,0|2,0,0]=4 4735 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 1626a_100020586998_100000061944 [0,1,0,0,1,0|2,0,0]=4 4736 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 240690a_100020586998_100000061944 [0,1,0,0,1,0|2,0,0]=4 4737 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 527a_100020586998_100000061944 [0,1,0,0,1,0|2,0,0]=4 4738 B14R1.33 C=CCNC(=O)Cn1ccc(=O)cc1 1626a_100020586998_200000238563 [0,1,0,0,1,0|2,0,0]=4 4739 B14R1.33 C=CCNC(=O)Cn1ccc(=O)cc1 240690a_100020586998_200000238563 [0,1,0,0,1,0|2,0,0]=4 4740 B14R1.33 C=CCNC(=O)Cn1ccc(=O)cc1 527a_100020586998_200000238563 [0,1,0,0,1,0|2,0,0]=4 4741 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020586998 [0,1,0,0,1,0|2,0,0]=4 4742 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020586998 [0,1,0,0,1,0|2,0,0]=4 4743 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020586998 [0,1,0,0,1,0|2,0,0]=4 4744 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020586998 [0,1,0,0,1,0|2,0,0]=4 4745 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020586998 [0,1,0,0,1,0|2,0,0]=4 4746 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020586998 [0,1,0,0,1,0|2,0,0]=4 4747 B14R1.33 C=CCOC(C)Cc1ccc(cc1)F 34a_100011351027_100015514636 [0,1,0,0,1,0|1,0,1]=4 4748 B14R1.33 C=CCOC(C)Cc1ccc(cc1)F 7a_100011351027_100015514636 [0,1,0,0,1,0|1,0,1]=4 4749 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)Br 1458a_100016291481_100000211773 [0,1,0,0,1,0|1,0,1]=4 4750 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)C 1458a_100016291481_100000211840 [0,1,0,0,1,0|1,0,1]=4 4751 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)Cl 1458a_100016291481_100000181238 [0,1,0,0,1,0|1,0,1]=4 4752 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)F 1458a_100016291481_100000230114 [0,1,0,0,1,0|1,0,1]=4 4753 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)I 1458a_100016291481_100011218688 [0,1,0,0,1,0|1,0,1]=4 4754 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)O 1458a_100016291481_100011660834 [0,1,0,0,1,0|1,0,1]=4 4755 B14R1.34 C=CCCC(=O)Cc1cc(ccn1)Br 1458a_100000749702_100010173614 [0,1,0,0,1,0|2,0,0]=4 4756 B14R1.34 C=CCCC(=O)Cc1cc(ccn1)C 1458a_100000749702_100000718516 [0,1,0,0,1,0|2,0,0]=4 4757 B14R1.34 C=CCCC(=O)Cc1cc(ccn1)Cl 1458a_100000749702_100016988179 [0,1,0,0,1,0|2,0,0]=4 4758 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000754431 [0,1,0,0,1,0|1,0,0]=3 4759 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Br 1458a_100000749702_100000211773 [0,1,0,0,1,0|1,0,0]=3 4760 B14R1.34 C=CCCC(=O)Cc1cccc(c1)C 1458a_100000749702_100000211840 [0,1,0,0,1,0|1,0,0]=3 4761 B14R1.34 C=CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000754431 [0,1,0,0,1,0|1,0,0]=3 4762 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000754431 [0,1,0,0,1,0|1,0,0]=3 4763 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749702_100000181238 [0,1,0,0,1,0|1,0,0]=3 4764 B14R1.34 C=CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000754431 [0,1,0,0,1,0|1,0,0]=3 4765 B14R1.34 C=CCCC(=O)Cc1cccc(c1)F 1458a_100000749702_100000230114 [0,1,0,0,1,0|1,0,0]=3 4766 B14R1.34 C=CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000754431 [0,1,0,0,1,0|1,0,0]=3 4767 B14R1.34 C=CCCC(=O)Cc1cccc(c1)I 1458a_100000749702_100011218688 [0,1,0,0,1,0|1,0,0]=3 4768 B14R1.34 C=CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000754431 [0,1,0,0,1,0|1,0,0]=3 4769 B14R1.34 C=CCCC(=O)Cc1cccc(c1)O 1458a_100000749702_100011660834 [0,1,0,0,1,0|1,0,0]=3 4770 B14R1.34 C=CCCC(=O)Cc1cccc(n1)Br 1458a_100000749702_100009889011 [0,1,0,0,1,0|2,0,0]=4 4771 B14R1.34 C=CCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000754431 [0,1,0,0,1,0|2,0,0]=4 4772 B14R1.34 C=CCCC(=O)Cc1cccc(n1)C 1458a_100000749702_100000757606 [0,1,0,0,1,0|2,0,0]=4 4773 B14R1.34 C=CCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000754431 [0,1,0,0,1,0|2,0,0]=4 4774 B14R1.34 C=CCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000754431 [0,1,0,0,1,0|2,0,0]=4 4775 B14R1.34 C=CCCC(=O)Cc1cccc(n1)Cl 1458a_100000749702_100000086093 [0,1,0,0,1,0|2,0,0]=4 4776 B14R1.34 C=CCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000754431 [0,1,0,0,1,0|2,0,0]=4 4777 B14R1.34 C=CCCC(=O)Cc1cccc(n1)F 1458a_100000749702_100009819644 [0,1,0,0,1,0|2,0,0]=4 4778 B14R1.34 C=CCCC(=O)Cc1ccnc(c1)Br 1458a_100000749702_100010243470 [0,1,0,0,1,0|2,0,0]=4 4779 B14R1.34 C=CCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000754431 [0,1,0,0,1,0|2,0,0]=4 4780 B14R1.34 C=CCCC(=O)Cc1ccnc(c1)C 1458a_100000749702_200020672517 [0,1,0,0,1,0|2,0,0]=4 4781 B14R1.34 C=CCCC(=O)Cc1ccnc(c1)Cl 1458a_100000749702_100000764220 [0,1,0,0,1,0|2,0,0]=4 4782 B14R1.34 C=CCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000754431 [0,1,0,0,1,0|2,0,0]=4 4783 B14R1.34 C=CCCC(=O)Cc1cncc(c1)Br 1458a_100000749702_100011740620 [0,1,0,0,1,0|2,0,0]=4 4784 B14R1.34 C=CCCC(=O)Cc1cncc(c1)C 1458a_100000749702_100000716715 [0,1,0,0,1,0|2,0,0]=4 4785 B14R1.34 C=CCCC(=O)Cc1cncc(c1)Cl 1458a_100000749702_100016992070 [0,1,0,0,1,0|2,0,0]=4 4786 B14R1.34 C=CCCC(=O)Cc1cncc(c1)F 1458a_100000749702_100000725299 [0,1,0,0,1,0|2,0,0]=4 4787 B14R1.34 C=CCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000754431 [0,1,0,0,1,0|2,0,0]=4 4788 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000749702 [0,1,0,0,1,0|2,0,0]=4 4789 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000749702 [0,1,0,0,1,0|2,0,0]=4 4790 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000749702 [0,1,0,0,1,0|2,0,0]=4 4791 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000749702 [0,1,0,0,1,0|2,0,0]=4 4792 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000749702 [0,1,0,0,1,0|2,0,0]=4 4793 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000749702 [0,1,0,0,1,0|2,0,0]=4 4794 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000749702 [0,1,0,0,1,0|2,0,0]=4 4795 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000749702 [0,1,0,0,1,0|2,0,0]=4 4796 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000749702 [0,1,0,0,1,0|2,0,0]=4 4797 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000749702 [0,1,0,0,1,0|2,0,0]=4 4798 B14R1.34 C=CCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000749702 [0,1,0,0,1,0|2,0,0]=4 4799 B14R1.34 C=CCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000749702 [0,1,0,0,1,0|2,0,0]=4 4800 B14R1.34 C=CCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000749702 [0,1,0,0,1,0|2,0,0]=4 4801 B14R1.34 C=CCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000749702 [0,1,0,0,1,0|2,0,0]=4 4802 B14R1.34 C=CCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000749702 [0,1,0,0,1,0|2,0,0]=4 4803 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000749702 [0,1,0,0,1,0|2,0,0]=4 4804 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000749702 [0,1,0,0,1,0|2,0,0]=4 4805 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000749702 [0,1,0,0,1,0|2,0,0]=4 4806 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000749702 [0,1,0,0,1,0|2,0,0]=4 4807 B14R1.34 C=CCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000749702 [0,1,0,0,1,0|2,0,0]=4 4808 B14R1.34 C=CCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000749702 [0,1,0,0,1,0|2,0,0]=4 4809 B14R1.34 C=CCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000749702 [0,1,0,0,1,0|2,0,0]=4 4810 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Br 240690a_100020586998_100000747190 [0,1,0,0,1,0|1,0,0]=3 4811 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Br 527a_100020586998_100000747190 [0,1,0,0,1,0|1,0,0]=3 4812 B14R1.34 C=CCNC(=O)Cc1cccc(c1)C 1626a_100020586998_100011206899 [0,1,0,0,1,0|1,0,0]=3 4813 B14R1.34 C=CCNC(=O)Cc1cccc(c1)C 240690a_100020586998_100011206899 [0,1,0,0,1,0|1,0,0]=3 4814 B14R1.34 C=CCNC(=O)Cc1cccc(c1)C 527a_100020586998_100011206899 [0,1,0,0,1,0|1,0,0]=3 4815 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Cl 1626a_100020586998_100000749307 [0,1,0,0,1,0|1,0,0]=3 4816 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Cl 240690a_100020586998_100000749307 [0,1,0,0,1,0|1,0,0]=3 4817 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Cl 527a_100020586998_100000749307 [0,1,0,0,1,0|1,0,0]=3 4818 B14R1.34 C=CCNC(=O)Cc1cccc(c1)F 1626a_100020586998_100000211661 [0,1,0,0,1,0|1,0,0]=3 4819 B14R1.34 C=CCNC(=O)Cc1cccc(c1)F 240690a_100020586998_100000211661 [0,1,0,0,1,0|1,0,0]=3 4820 B14R1.34 C=CCNC(=O)Cc1cccc(c1)F 527a_100020586998_100000211661 [0,1,0,0,1,0|1,0,0]=3 4821 B14R1.34 C=CCNC(=O)Cc1cccc(c1)I 1626a_100020586998_100000238430 [0,1,0,0,1,0|1,0,0]=3 4822 B14R1.34 C=CCNC(=O)Cc1cccc(c1)I 240690a_100020586998_100000238430 [0,1,0,0,1,0|1,0,0]=3 4823 B14R1.34 C=CCNC(=O)Cc1cccc(c1)I 527a_100020586998_100000238430 [0,1,0,0,1,0|1,0,0]=3 4824 B14R1.34 C=CCNC(=O)Cc1cccc(c1)O 240690a_100020586998_100000745134 [0,1,0,0,1,0|1,0,0]=3 4825 B14R1.34 C=CCNC(=O)Cc1cccc(c1)O 527a_100020586998_100000745134 [0,1,0,0,1,0|1,0,0]=3 4826 B14R1.34 C=CCNC(=O)Cc1cccc(n1)Br 240690a_100020586998_100010201708 [0,1,0,0,1,0|2,0,0]=4 4827 B14R1.34 C=CCNC(=O)Cc1cccc(n1)Br 527a_100020586998_100010201708 [0,1,0,0,1,0|2,0,0]=4 4828 B14R1.34 C=CCNC(=O)Cc1cccc(n1)C 1626a_100020586998_100012001110 [0,1,0,0,1,0|2,0,0]=4 4829 B14R1.34 C=CCNC(=O)Cc1cccc(n1)C 240690a_100020586998_100012001110 [0,1,0,0,1,0|2,0,0]=4 4830 B14R1.34 C=CCNC(=O)Cc1cccc(n1)C 527a_100020586998_100012001110 [0,1,0,0,1,0|2,0,0]=4 4831 B14R1.34 C=CCNC(=O)Cc1cccc(n1)Cl 1626a_100020586998_100000090259 [0,1,0,0,1,0|2,0,0]=4 4832 B14R1.34 C=CCNC(=O)Cc1cccc(n1)Cl 240690a_100020586998_100000090259 [0,1,0,0,1,0|2,0,0]=4 4833 B14R1.34 C=CCNC(=O)Cc1cccc(n1)F 1626a_100020586998_100000096803 [0,1,0,0,1,0|2,0,0]=4 4834 B14R1.34 C=CCNC(=O)Cc1cccc(n1)F 240690a_100020586998_100000096803 [0,1,0,0,1,0|2,0,0]=4 4835 B14R1.34 C=CCNC(=O)Cc1ccnc(c1)Br 240690a_100020586998_100010126891 [0,1,0,0,1,0|2,0,0]=4 4836 B14R1.34 C=CCNC(=O)Cc1ccnc(c1)Br 527a_100020586998_100010126891 [0,1,0,0,1,0|2,0,0]=4 4837 B14R1.34 C=CCNC(=O)Cc1ccnc(c1)Cl 1626a_100020586998_100000085289 [0,1,0,0,1,0|2,0,0]=4 4838 B14R1.34 C=CCNC(=O)Cc1ccnc(c1)Cl 240690a_100020586998_100000085289 [0,1,0,0,1,0|2,0,0]=4 4839 B14R1.34 C=CCNC(=O)Cc1ccnc(c1)Cl 527a_100020586998_100000085289 [0,1,0,0,1,0|2,0,0]=4 4840 B14R1.34 C=CCNC(=O)Cc1cncc(c1)Br 240690a_100020586998_100000239331 [0,1,0,0,1,0|2,0,0]=4 4841 B14R1.34 C=CCNC(=O)Cc1cncc(c1)Br 527a_100020586998_100000239331 [0,1,0,0,1,0|2,0,0]=4 4842 B14R1.34 C=CCNC(=O)Cc1cncc(c1)F 240690a_100020586998_100011667516 [0,1,0,0,1,0|2,0,0]=4 4843 B14R1.34 C=CCNC(=O)Cc1cncc(c1)F 527a_100020586998_100011667516 [0,1,0,0,1,0|2,0,0]=4 4844 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100020586998 [0,1,0,0,1,0|2,0,0]=4 4845 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100020586998 [0,1,0,0,1,0|2,0,0]=4 4846 B14R1.34 C=CCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100020586998 [0,1,0,0,1,0|2,0,0]=4 4847 B14R1.34 C=CCNC(=O)Nc1cccc(c1)C 512a_100000188690_100020586998 [0,1,0,0,1,0|2,0,0]=4 4848 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100020586998 [0,1,0,0,1,0|2,0,0]=4 4849 B14R1.34 C=CCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100020586998 [0,1,0,0,1,0|2,0,0]=4 4850 B14R1.34 C=CCNC(=O)Nc1cccc(c1)F 512a_100000210047_100020586998 [0,1,0,0,1,0|2,0,0]=4 4851 B14R1.34 C=CCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100020586998 [0,1,0,0,1,0|2,0,0]=4 4852 B14R1.34 C=CCNC(=O)Nc1cccc(c1)I 512a_100000211102_100020586998 [0,1,0,0,1,0|2,0,0]=4 4853 B14R1.34 C=CCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100020586998 [0,1,0,0,1,0|2,0,0]=4 4854 B14R1.34 C=CCNC(=O)Nc1cccc(c1)O 512a_100000210217_100020586998 [0,1,0,0,1,0|2,0,0]=4 4855 B14R1.166 C=CC=CC(=O)C(C)c1ccccc1 1458a_100016291481_100000230085 [0,1,0,0,1,0|1,0,1]=4 4856 B14R1.166 C=CCCC(=O)C(=C)c1ccccc1 1458a_100000065200_100000754431 [0,1,0,0,1,0|1,0,1]=4 4857 B14R1.166 C=CCCC(=O)C(C)c1ccccc1 1458a_100000749702_100000230085 [0,1,0,0,1,0|1,0,0]=3 4858 B14R1.166 C=CCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000754431 [0,1,0,0,1,0|2,0,0]=4 4859 B14R1.166 C=CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000754431 [0,1,0,0,1,0|1,0,0]=3 4860 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749702 [0,1,0,0,1,0|2,0,0]=4 4861 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749702 [0,1,0,0,1,0|2,0,0]=4 4862 B14R1.166 C=CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749702 [0,1,0,0,1,0|2,0,0]=4 4863 B14R1.166 C=CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000754431 [0,1,0,0,1,0|1,0,0]=3 4864 B14R1.166 C=CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000754431 [0,1,0,0,1,0|1,0,0]=3 4865 B14R1.166 C=CCNC(=O)C(=C)c1ccccc1 1626a_100020586998_100000065200 [0,1,0,0,1,0|1,0,1]=4 4866 B14R1.166 C=CCNC(=O)C(C)c1ccccn1 1626a_100020586998_100000722050 [0,1,0,0,1,0|2,0,0]=4 4867 B14R1.166 C=CCNC(=O)C(C)c1ccccn1 240690a_100020586998_100000722050 [0,1,0,0,1,0|2,0,0]=4 4868 B14R1.166 C=CCNC(=O)C(C)c1ccccn1 527a_100020586998_100000722050 [0,1,0,0,1,0|2,0,0]=4 4869 B14R1.166 C=CCNC(=O)C(F)c1ccccc1 1626a_100020586998_100000698975 [0,1,0,0,1,0|1,0,0]=3 4870 B14R1.166 C=CCNC(=O)C(F)c1ccccc1 240690a_100020586998_100000698975 [0,1,0,0,1,0|1,0,0]=3 4871 B14R1.166 C=CCNC(=O)C(F)c1ccccc1 527a_100020586998_100000698975 [0,1,0,0,1,0|1,0,0]=3 4872 B14R1.166 C=CCNC(=O)N(C)c1ccccc1 512a_100020586998_100000210012 [0,1,0,0,1,0|2,0,0]=4 4873 B14R1.166 C=CCNC(=O)[C@@H](C)c1ccccc1 1626a_100020586998_100000751047 [0,1,0,0,1,0|1,0,0]=3 4874 B14R1.166 C=CCNC(=O)[C@@H](C)c1ccccc1 240690a_100020586998_100000751047 [0,1,0,0,1,0|1,0,0]=3 4875 B14R1.166 C=CCNC(=O)[C@@H](C)c1ccccc1 527a_100020586998_100000751047 [0,1,0,0,1,0|1,0,0]=3 4876 B14R1.166 C=CCNC(=O)[C@H](O)c1ccccc1 240690a_100020586998_100000684486 [0,1,0,0,1,0|1,0,0]=3 4877 B14R1.166 C=CCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100015514636 [0,1,0,0,1,0|1,0,1]=4 4878 B14R1.423 C=C(C)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000730704 [0,1,0,0,1,0|2,0,0]=4 4879 B14R1.423 C=C(C)CCC(=O)Cc1ccccc1 1458a_200000688413_100015291786 [0,1,0,0,1,0|1,0,0]=3 4880 B14R1.423 C=C(C)CCC(=O)Cc1ccccn1 1458a_100000233486_100000730704 [0,1,0,0,1,0|2,0,0]=4 4881 B14R1.423 C=C(C)CCC(=O)Cc1ccccn1 1458a_200000688413_100000721315 [0,1,0,0,1,0|2,0,0]=4 4882 B14R1.423 C=C(C)CCC(=O)Cc1cccnc1 1458a_100000737805_100000730704 [0,1,0,0,1,0|2,0,0]=4 4883 B14R1.423 C=C(C)CCC(=O)Cc1cccnc1 1458a_200000688413_100000733263 [0,1,0,0,1,0|2,0,0]=4 4884 B14R1.423 C=C(C)CCC(=O)Cc1ccncc1 1458a_200000688413_100000705612 [0,1,0,0,1,0|2,0,0]=4 4885 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 11a_100000106764_200000688413 [0,1,0,0,1,0|2,0,0]=4 4886 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 1626a_100000106764_200000688413 [0,1,0,0,1,0|2,0,0]=4 4887 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 22a_100000106764_200000688413 [0,1,0,0,1,0|2,0,0]=4 4888 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 527a_100000106764_200000688413 [0,1,0,0,1,0|2,0,0]=4 4889 B14R1.423 C=C(C)CNC(=O)C[n+]1ccccc1 11a_100000765925_200000086051 [0,1,0,0,1,0|2,0,0]=4 4890 B14R1.423 C=C(C)CNC(=O)C[n+]1ccccc1 240690a_100000765925_200000086051 [0,1,0,0,1,0|2,0,0]=4 4891 B14R1.423 C=C(C)CNC(=O)C[n+]1ccccc1 527a_100000765925_200000086051 [0,1,0,0,1,0|2,0,0]=4 4892 B14R1.423 C=C(C)CNC(=O)Cc1ccccn1 11a_100000765925_100000233486 [0,1,0,0,1,0|2,0,0]=4 4893 B14R1.423 C=C(C)CNC(=O)Cc1cccnc1 11a_100000765925_100000737805 [0,1,0,0,1,0|2,0,0]=4 4894 B14R1.423 C=C(C)CNC(=O)Cc1cccnc1 240690a_100000765925_100000737805 [0,1,0,0,1,0|2,0,0]=4 4895 B14R1.423 C=C(C)CNC(=O)Cc1cccnc1 527a_100000765925_100000737805 [0,1,0,0,1,0|2,0,0]=4 4896 B14R1.423 C=C(C)CNC(=O)Cc1ccncc1 11a_100000765925_100011201483 [0,1,0,0,1,0|2,0,0]=4 4897 B14R1.423 C=C(C)CNC(=O)Cc1ccncc1 240690a_100000765925_100011201483 [0,1,0,0,1,0|2,0,0]=4 4898 B14R1.423 C=C(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100000765925 [0,1,0,0,1,0|2,0,0]=4 4899 B14R1.423 C=C(C)COC(C)Cc1ccccc1 34a_100000210245_200011218536 [0,1,0,0,1,0|1,0,1]=4 4900 B14R1.423 C=C(C)COC(C)Cc1ccccc1 34a_100000748627_100000748629 [0,1,0,0,1,0|1,0,1]=4 4901 B14R1.423 C=C(C)COC(C)Cc1ccccc1 7a_100000748627_100000748629 [0,1,0,0,1,0|1,0,1]=4 4902 B14R1.423 C=C(F)COC(C)Cc1ccccc1 34a_100000748627_100009893438 [0,1,0,0,1,0|1,0,1]=4 4903 B14R1.423 C=C(F)COC(C)Cc1ccccc1 34a_200010262243_200011218536 [0,1,0,0,1,0|1,0,1]=4 4904 B14R1.423 C=C(F)COC(C)Cc1ccccc1 7a_100000748627_100000042424 [0,1,0,0,1,0|1,0,1]=4 4905 B14R1.423 CC(=O)CCC(=O)Oc1ccccc1 1458a_100000070787_200000035796 [0,1,0,0,1,0|1,0,1]=4 4906 B14R1.423 CC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200000210301 [0,1,0,0,1,0|1,0,1]=4 4907 B14R1.423 NC(=O)CCC(=O)Cc1ccccc1 1458a_100011215257_100015291786 [0,1,0,0,1,0|2,0,0]=4 4908 B14R1.423 [13CH3]C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200025704644 [0,1,0,0,1,0|1,0,1]=4 4909 B14R1.467 C#CC(Cc1ccccc1)OCC=C 34a_100000685211_100015514636 [0,1,0,0,1,0|1,0,1]=4 4910 B14R1.467 C#CC(Cc1ccccc1)OCC=C 7a_100000685211_100015514636 [0,1,0,0,1,0|1,0,1]=4 4911 B14R1.467 C=CCOC(CC)Cc1ccccc1 7a_100000760156_100015514636 [0,1,0,0,1,0|1,0,1]=4 4912 B14R1.467 C=CCOC(CN)Cc1ccccc1 34a_100000752270_100015514636 [0,1,0,0,1,0|1,0,1]=4 4913 B14R1.467 C=CCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100015514636 [0,1,0,0,1,0|1,0,1]=4 4914 B14R1.743 C=CC(=O)CC(=O)Cc1ccccc1 1458a_100000185746_100000233483 [0,1,0,0,1,0|1,0,1]=4 4915 B14R1.743 C=CC(=O)CC(=O)Oc1ccccc1 1458a_100000185746_100009813826 [0,1,0,0,1,0|1,0,1]=4 4916 B14R1.743 C=CC(C)CC(=O)Cc1ccccc1 1458a_100011934298_100015291786 [0,1,0,0,1,0|1,0,0]=3 4917 B14R1.743 C=CC(C)CC(=O)Cc1ccccn1 1458a_100011934298_100000721315 [0,1,0,0,1,0|2,0,0]=4 4918 B14R1.743 C=CC(C)CC(=O)Cc1cccnc1 1458a_100011934298_100000733263 [0,1,0,0,1,0|2,0,0]=4 4919 B14R1.743 C=CC(C)CC(=O)Cc1ccncc1 1458a_100011934298_100000705612 [0,1,0,0,1,0|2,0,0]=4 4920 B14R1.743 C=CC(C)CC(=O)Nc1ccccc1 11a_100000106764_100011934298 [0,1,0,0,1,0|2,0,0]=4 4921 B14R1.743 C=CC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100011934298 [0,1,0,0,1,0|2,0,0]=4 4922 B14R1.743 C=CC(C)CC(=O)Nc1ccccc1 22a_100000106764_100011934298 [0,1,0,0,1,0|2,0,0]=4 4923 B14R1.743 C=CC(C)CC(=O)Nc1ccccc1 527a_100000106764_100011934298 [0,1,0,0,1,0|2,0,0]=4 4924 B14R1.743 C=CC(C)OC(C)Cc1ccccc1 34a_100000695699_200011218536 [0,1,0,0,1,0|1,0,1]=4 4925 B14R1.946 C=CC=CC(=O)Cc1ccccc1Br 1458a_100016291481_100000184730 [0,1,0,0,1,0|1,0,1]=4 4926 B14R1.946 C=CC=CC(=O)Cc1ccccc1C 1458a_100016291481_100000211839 [0,1,0,0,1,0|1,0,1]=4 4927 B14R1.946 C=CC=CC(=O)Cc1ccccc1Cl 1458a_100016291481_100000187162 [0,1,0,0,1,0|1,0,1]=4 4928 B14R1.946 C=CC=CC(=O)Cc1ccccc1F 1458a_100016291481_100000187165 [0,1,0,0,1,0|1,0,1]=4 4929 B14R1.946 C=CC=CC(=O)Cc1ccccc1I 1458a_100016291481_100011216222 [0,1,0,0,1,0|1,0,1]=4 4930 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000749702_100000184730 [0,1,0,0,1,0|1,0,0]=3 4931 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000754431 [0,1,0,0,1,0|1,0,0]=3 4932 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000754431 [0,1,0,0,1,0|1,0,0]=3 4933 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000749702_100000211839 [0,1,0,0,1,0|1,0,0]=3 4934 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000754431 [0,1,0,0,1,0|1,0,0]=3 4935 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000749702_100000187162 [0,1,0,0,1,0|1,0,0]=3 4936 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000754431 [0,1,0,0,1,0|1,0,0]=3 4937 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000749702_100000187165 [0,1,0,0,1,0|1,0,0]=3 4938 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000754431 [0,1,0,0,1,0|1,0,0]=3 4939 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000749702_100011216222 [0,1,0,0,1,0|1,0,0]=3 4940 B14R1.946 C=CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000754431 [0,1,0,0,1,0|1,0,0]=3 4941 B14R1.946 C=CCCC(=O)Cc1cccnc1Br 1458a_100000749702_100010140945 [0,1,0,0,1,0|2,0,0]=4 4942 B14R1.946 C=CCCC(=O)Cc1cccnc1C 1458a_100000749702_100000732876 [0,1,0,0,1,0|2,0,0]=4 4943 B14R1.946 C=CCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000754431 [0,1,0,0,1,0|2,0,0]=4 4944 B14R1.946 C=CCCC(=O)Cc1cccnc1Cl 1458a_100000749702_100000045678 [0,1,0,0,1,0|2,0,0]=4 4945 B14R1.946 C=CCCC(=O)Cc1cccnc1F 1458a_100000749702_100000099810 [0,1,0,0,1,0|2,0,0]=4 4946 B14R1.946 C=CCCC(=O)Cc1ccncc1C 1458a_100000749702_100020672808 [0,1,0,0,1,0|2,0,0]=4 4947 B14R1.946 C=CCCC(=O)Cc1ccncc1Cl 1458a_100000749702_100000763264 [0,1,0,0,1,0|2,0,0]=4 4948 B14R1.946 C=CCCC(=O)Cc1cnccc1C 1458a_100000749702_100000690890 [0,1,0,0,1,0|2,0,0]=4 4949 B14R1.946 C=CCCC(=O)Cc1ncccc1Br 1458a_100000749702_100025702911 [0,1,0,0,1,0|2,0,0]=4 4950 B14R1.946 C=CCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000754431 [0,1,0,0,1,0|2,0,0]=4 4951 B14R1.946 C=CCCC(=O)Cc1ncccc1C 1458a_100000749702_100000696600 [0,1,0,0,1,0|2,0,0]=4 4952 B14R1.946 C=CCCC(=O)Cc1ncccc1C 1458a_200000722269_100000754431 [0,1,0,0,1,0|2,0,0]=4 4953 B14R1.946 C=CCCC(=O)Cc1ncccc1Cl 1458a_100000749702_100000099807 [0,1,0,0,1,0|2,0,0]=4 4954 B14R1.946 C=CCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000754431 [0,1,0,0,1,0|2,0,0]=4 4955 B14R1.946 C=CCCC(=O)Cc1ncccc1F 1458a_100000749702_100000104219 [0,1,0,0,1,0|2,0,0]=4 4956 B14R1.946 C=CCCC(=O)Cc1ncccc1O 1458a_100000749702_200020655725 [0,1,0,0,1,0|2,0,0]=4 4957 B14R1.946 C=CCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000754431 [0,1,0,0,1,0|2,0,0]=4 4958 B14R1.946 C=CCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749702 [0,1,0,0,1,0|2,0,0]=4 4959 B14R1.946 C=CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749702 [0,1,0,0,1,0|2,0,0]=4 4960 B14R1.946 C=CCCC(=O)Nc1ccccc1C 11a_100015192222_100000749702 [0,1,0,0,1,0|2,0,0]=4 4961 B14R1.946 C=CCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749702 [0,1,0,0,1,0|2,0,0]=4 4962 B14R1.946 C=CCCC(=O)Nc1ccccc1C 22a_100015192222_100000749702 [0,1,0,0,1,0|2,0,0]=4 4963 B14R1.946 C=CCCC(=O)Nc1ccccc1C 527a_100015192222_100000749702 [0,1,0,0,1,0|2,0,0]=4 4964 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749702 [0,1,0,0,1,0|2,0,0]=4 4965 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749702 [0,1,0,0,1,0|2,0,0]=4 4966 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749702 [0,1,0,0,1,0|2,0,0]=4 4967 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749702 [0,1,0,0,1,0|2,0,0]=4 4968 B14R1.946 C=CCCC(=O)Nc1ccccc1F 11a_100000210422_100000749702 [0,1,0,0,1,0|2,0,0]=4 4969 B14R1.946 C=CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749702 [0,1,0,0,1,0|2,0,0]=4 4970 B14R1.946 C=CCCC(=O)Nc1ccccc1F 22a_100000210422_100000749702 [0,1,0,0,1,0|2,0,0]=4 4971 B14R1.946 C=CCCC(=O)Nc1ccccc1F 527a_100000210422_100000749702 [0,1,0,0,1,0|2,0,0]=4 4972 B14R1.946 C=CCCC(=O)Nc1ccccc1I 11a_100000210053_100000749702 [0,1,0,0,1,0|2,0,0]=4 4973 B14R1.946 C=CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749702 [0,1,0,0,1,0|2,0,0]=4 4974 B14R1.946 C=CCCC(=O)Nc1ccccc1O 22a_100000185747_100000749702 [0,1,0,0,1,0|2,0,0]=4 4975 B14R1.946 C=CCCC(=O)Nc1ccccc1O 527a_100000185747_100000749702 [0,1,0,0,1,0|2,0,0]=4 4976 B14R1.946 C=CCNC(=O)Cc1ccccc1Br 240690a_100020586998_100000751119 [0,1,0,0,1,0|1,0,0]=3 4977 B14R1.946 C=CCNC(=O)Cc1ccccc1Br 527a_100020586998_100000751119 [0,1,0,0,1,0|1,0,0]=3 4978 B14R1.946 C=CCNC(=O)Cc1ccccc1C 1626a_100020586998_100000212180 [0,1,0,0,1,0|1,0,0]=3 4979 B14R1.946 C=CCNC(=O)Cc1ccccc1C 240690a_100020586998_100000212180 [0,1,0,0,1,0|1,0,0]=3 4980 B14R1.946 C=CCNC(=O)Cc1ccccc1C 527a_100020586998_100000212180 [0,1,0,0,1,0|1,0,0]=3 4981 B14R1.946 C=CCNC(=O)Cc1ccccc1Cl 1626a_100020586998_100000183793 [0,1,0,0,1,0|1,0,0]=3 4982 B14R1.946 C=CCNC(=O)Cc1ccccc1Cl 240690a_100020586998_100000183793 [0,1,0,0,1,0|1,0,0]=3 4983 B14R1.946 C=CCNC(=O)Cc1ccccc1Cl 527a_100020586998_100000183793 [0,1,0,0,1,0|1,0,0]=3 4984 B14R1.946 C=CCNC(=O)Cc1ccccc1F 1626a_100020586998_100000212012 [0,1,0,0,1,0|1,0,0]=3 4985 B14R1.946 C=CCNC(=O)Cc1ccccc1F 240690a_100020586998_100000212012 [0,1,0,0,1,0|1,0,0]=3 4986 B14R1.946 C=CCNC(=O)Cc1ccccc1F 527a_100020586998_100000212012 [0,1,0,0,1,0|1,0,0]=3 4987 B14R1.946 C=CCNC(=O)Cc1ccccc1I 1626a_100020586998_100000036491 [0,1,0,0,1,0|1,0,0]=3 4988 B14R1.946 C=CCNC(=O)Cc1ccccc1I 240690a_100020586998_100000036491 [0,1,0,0,1,0|1,0,0]=3 4989 B14R1.946 C=CCNC(=O)Cc1ccccc1I 527a_100020586998_100000036491 [0,1,0,0,1,0|1,0,0]=3 4990 B14R1.946 C=CCNC(=O)Cc1ccccc1O 240690a_100020586998_100000743006 [0,1,0,0,1,0|1,0,0]=3 4991 B14R1.946 C=CCNC(=O)Cc1ccccc1O 527a_100020586998_100000743006 [0,1,0,0,1,0|1,0,0]=3 4992 B14R1.946 C=CCNC(=O)Cc1cccnc1Cl 1626a_100020586998_100000093521 [0,1,0,0,1,0|2,0,0]=4 4993 B14R1.946 C=CCNC(=O)Cc1cccnc1Cl 240690a_100020586998_100000093521 [0,1,0,0,1,0|2,0,0]=4 4994 B14R1.946 C=CCNC(=O)Cc1cccnc1Cl 527a_100020586998_100000093521 [0,1,0,0,1,0|2,0,0]=4 4995 B14R1.946 C=CCNC(=O)Cc1ncccc1Br 240690a_100020586998_200012357574 [0,1,0,0,1,0|2,0,0]=4 4996 B14R1.946 C=CCNC(=O)Cc1ncccc1C 1626a_100020586998_200000722269 [0,1,0,0,1,0|2,0,0]=4 4997 B14R1.946 C=CCNC(=O)Cc1ncccc1C 240690a_100020586998_200000722269 [0,1,0,0,1,0|2,0,0]=4 4998 B14R1.946 C=CCNC(=O)Cc1ncccc1Cl 240690a_100020586998_100011998755 [0,1,0,0,1,0|2,0,0]=4 4999 B14R1.946 C=CCNC(=O)Cc1ncccc1Cl 527a_100020586998_100011998755 [0,1,0,0,1,0|2,0,0]=4 5000 B14R1.946 C=CCNC(=O)Cn1ccccc1=O 1626a_100020586998_100000189665 [0,1,0,0,1,0|2,0,0]=4 5001 B14R1.946 C=CCNC(=O)Cn1ccccc1=O 240690a_100020586998_100000189665 [0,1,0,0,1,0|2,0,0]=4 5002 B14R1.946 C=CCNC(=O)Cn1ccccc1=O 527a_100020586998_100000189665 [0,1,0,0,1,0|2,0,0]=4 5003 B14R1.946 C=CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100020586998 [0,1,0,0,1,0|2,0,0]=4 5004 B14R1.946 C=CCNC(=O)Nc1ccccc1C 2430a_100015192222_100020586998 [0,1,0,0,1,0|2,0,0]=4 5005 B14R1.946 C=CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020586998 [0,1,0,0,1,0|2,0,0]=4 5006 B14R1.946 C=CCNC(=O)Nc1ccccc1F 2430a_100000210422_100020586998 [0,1,0,0,1,0|2,0,0]=4 5007 B14R1.946 C=CCNC(=O)Nc1ccccc1I 2430a_100000210053_100020586998 [0,1,0,0,1,0|2,0,0]=4 5008 B14R1.946 C=CCNC(=O)Nc1ccccc1O 2430a_100000185747_100020586998 [0,1,0,0,1,0|2,0,0]=4 5009 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 270084a_100020586998_100000211737 [0,1,0,0,1,0|2,0,0]=4 5010 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 274078a_100020586998_100000211737 [0,1,0,0,1,0|2,0,0]=4 5011 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 40a_100020586998_100000235865 [0,1,0,0,1,0|2,0,0]=4 5012 B14R1.4528 C=CCOC(C)(C)Cc1ccccc1 7a_100011215222_100015514636 [0,1,0,0,1,0|1,0,1]=4 5013 B14R1.155 C=CCOC(=O)COc1ccn(n1)C 34a_100012642153_100000033060 [0,1,0,0,1,0|2,0,0]=4 5014 B14R1.155 C=CCOC(=O)COc1cnn(c1)C 34a_100000707646_100000033060 [0,1,0,0,1,0|2,0,0]=4 5015 B14R1.155 C=CCOC(=O)CSc1cc(cs1)C 62a_100000033060_100009876951 [0,1,0,0,1,0|1,1,0]=4 5016 B14R1.155 C=CCOC(=O)CSc1cc(cs1)C 62a_100009876951_100000033060 [0,1,0,0,1,0|1,1,0]=4 5017 B14R1.155 C=CCOC(=O)CSc1ccc(s1)Br 62a_100000033060_100010197418 [0,1,0,0,1,0|1,1,0]=4 5018 B14R1.155 C=CCOC(=O)CSc1ccc(s1)Br 62a_100010197418_100000033060 [0,1,0,0,1,0|1,1,0]=4 5019 B14R1.155 C=CCOC(=O)CSc1ccc(s1)C 62a_100000031368_100000033060 [0,1,0,0,1,0|1,1,0]=4 5020 B14R1.155 C=CCOC(=O)CSc1ccc(s1)C 62a_100000033060_100000031368 [0,1,0,0,1,0|1,1,0]=4 5021 B14R1.155 C=CCOC(=O)CSc1csc(c1)C 62a_100000033060_100000759034 [0,1,0,0,1,0|1,1,0]=4 5022 B14R1.155 C=CCOC(=O)CSc1csc(c1)C 62a_100000759034_100000033060 [0,1,0,0,1,0|1,1,0]=4 5023 B14R1.454 C=CCNC(=O)C(C)Oc1ccsc1 7a_100000106738_100000230288 [0,1,0,0,1,0|2,0,0]=4 5024 B14R1.916 C=CCOC(=O)COc1ccnn1C 34a_100020632926_100000033060 [0,1,0,0,1,0|2,0,0]=4 5025 B14R1.916 C=CCOC(=O)CSc1ccsc1C 62a_100000033060_100000684487 [0,1,0,0,1,0|1,1,0]=4 5026 B14R1.916 C=CCOC(=O)CSc1ccsc1C 62a_100000684487_100000033060 [0,1,0,0,1,0|1,1,0]=4 5027 B14R1.916 C=CCOC(=O)CSc1cscc1Br 62a_100000033060_100010143727 [0,1,0,0,1,0|1,1,0]=4 5028 B14R1.916 C=CCOC(=O)CSc1cscc1Br 62a_100010143727_100000033060 [0,1,0,0,1,0|1,1,0]=4 5029 B14R1.916 C=CCOC(=O)CSc1cscc1C 62a_100000033060_100000759966 [0,1,0,0,1,0|1,1,0]=4 5030 B14R1.916 C=CCOC(=O)CSc1cscc1C 62a_100000759966_100000033060 [0,1,0,0,1,0|1,1,0]=4 5031 B14R1.916 C=CCOC(=O)CSc1sccc1Br 62a_100000033060_100012361411 [0,1,0,0,1,0|1,1,0]=4 5032 B14R1.916 C=CCOC(=O)CSc1sccc1Br 62a_100012361411_100000033060 [0,1,0,0,1,0|1,1,0]=4 5033 B14R1.916 C=CCOC(=O)CSc1sccc1C 62a_100000033060_100010247149 [0,1,0,0,1,0|1,1,0]=4 5034 B14R1.916 C=CCOC(=O)CSc1sccc1C 62a_100010247149_100000033060 [0,1,0,0,1,0|1,1,0]=4 5035 B16R1.8 C=CC=CC(=O)CCOc1ccc(cc1)Br 1458a_100016291481_100000183278 [0,1,0,0,0,1|1,0,1]=4 5036 B16R1.8 C=CC=CC(=O)CCOc1ccc(cc1)C 1458a_100016291481_100000183172 [0,1,0,0,0,1|1,0,1]=4 5037 B16R1.8 C=CC=CC(=O)CCOc1ccc(cc1)Cl 1458a_100016291481_100000184122 [0,1,0,0,0,1|1,0,1]=4 5038 B16R1.8 C=CC=CC(=O)CCOc1ccc(cc1)F 1458a_100016291481_100000184936 [0,1,0,0,0,1|1,0,1]=4 5039 B16R1.8 C=CCCC(=O)CC#Cc1ccc(cc1)Br 1458a_100000749702_100010706785 [0,1,0,0,0,1|2,0,0]=4 5040 B16R1.8 C=CCCC(=O)CC#Cc1ccc(cc1)F 1458a_100000749702_100010402171 [0,1,0,0,0,1|2,0,0]=4 5041 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)Br 1458a_100000749702_100011713682 [0,1,0,0,0,1|2,0,0]=4 5042 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)Br 1458a_100011236545_100000754431 [0,1,0,0,0,1|2,0,0]=4 5043 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)C 1458a_100000741418_100000754431 [0,1,0,0,0,1|2,0,0]=4 5044 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_100000754431 [0,1,0,0,0,1|2,0,0]=4 5045 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)Cl 1458a_100000749702_100000759440 [0,1,0,0,0,1|2,0,0]=4 5046 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)F 1458a_100000749702_200011713563 [0,1,0,0,0,1|2,0,0]=4 5047 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)F 1458a_100011219804_100000754431 [0,1,0,0,0,1|2,0,0]=4 5048 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)I 1458a_100011236544_100000754431 [0,1,0,0,0,1|2,0,0]=4 5049 B16R1.8 C=CCCC(=O)CCCc1ccc(cc1)O 1458a_100000116853_100000754431 [0,1,0,0,0,1|2,0,0]=4 5050 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)Br 1458a_100000738328_100000754431 [0,1,0,0,0,1|1,0,0]=3 5051 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)Br 1458a_100000749702_100000183278 [0,1,0,0,0,1|1,0,0]=3 5052 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)C 1458a_100000182323_100000754431 [0,1,0,0,0,1|1,0,0]=3 5053 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)C 1458a_100000749702_100000183172 [0,1,0,0,0,1|1,0,0]=3 5054 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_100000754431 [0,1,0,0,0,1|1,0,0]=3 5055 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)Cl 1458a_100000749702_100000184122 [0,1,0,0,0,1|1,0,0]=3 5056 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)F 1458a_100000737396_100000754431 [0,1,0,0,0,1|1,0,0]=3 5057 B16R1.8 C=CCCC(=O)CCOc1ccc(cc1)F 1458a_100000749702_100000184936 [0,1,0,0,0,1|1,0,0]=3 5058 B16R1.8 C=CCCC(=O)CCSc1ccc(cc1)Br 1458a_100000208627_100000754431 [0,1,0,0,0,1|1,1,0]=4 5059 B16R1.8 C=CCCC(=O)CCSc1ccc(cc1)C 1458a_100000182377_100000754431 [0,1,0,0,0,1|1,1,0]=4 5060 B16R1.8 C=CCCC(=O)CCSc1ccc(cc1)Cl 1458a_100000182369_100000754431 [0,1,0,0,0,1|1,1,0]=4 5061 B16R1.8 C=CCCC(=O)CCSc1ccc(cc1)F 1458a_100000199091_100000754431 [0,1,0,0,0,1|1,1,0]=4 5062 B16R1.8 C=CCCC(=O)COCc1ccc(cc1)Br 1458a_200012349173_100000754431 [0,1,0,0,0,1|1,0,0]=3 5063 B16R1.8 C=CCCC(=O)CSCc1ccc(cc1)Br 1458a_100000150267_100000754431 [0,1,0,0,0,1|1,1,0]=4 5064 B16R1.8 C=CCCC(=O)CSCc1ccc(cc1)Cl 1458a_100000150262_100000754431 [0,1,0,0,0,1|1,1,0]=4 5065 B16R1.8 C=CCCC(=O)CSCc1ccc(cc1)F 1458a_100000150272_100000754431 [0,1,0,0,0,1|1,1,0]=4 5066 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Br 11a_100000755846_100000749702 [0,1,0,0,0,1|2,0,0]=4 5067 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Br 1626a_100000755846_100000749702 [0,1,0,0,0,1|2,0,0]=4 5068 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Br 240690a_100000755846_100000749702 [0,1,0,0,0,1|2,0,0]=4 5069 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Br 527a_100000755846_100000749702 [0,1,0,0,0,1|2,0,0]=4 5070 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)C 11a_100000705350_100000749702 [0,1,0,0,0,1|2,0,0]=4 5071 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)C 1626a_100000705350_100000749702 [0,1,0,0,0,1|2,0,0]=4 5072 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)C 240690a_100000705350_100000749702 [0,1,0,0,0,1|2,0,0]=4 5073 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)C 527a_100000705350_100000749702 [0,1,0,0,0,1|2,0,0]=4 5074 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Cl 11a_100000185265_100000749702 [0,1,0,0,0,1|2,0,0]=4 5075 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Cl 1626a_100000185265_100000749702 [0,1,0,0,0,1|2,0,0]=4 5076 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Cl 240690a_100000185265_100000749702 [0,1,0,0,0,1|2,0,0]=4 5077 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)Cl 527a_100000185265_100000749702 [0,1,0,0,0,1|2,0,0]=4 5078 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)F 11a_100000199005_100000749702 [0,1,0,0,0,1|2,0,0]=4 5079 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)F 1626a_100000199005_100000749702 [0,1,0,0,0,1|2,0,0]=4 5080 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)F 240690a_100000199005_100000749702 [0,1,0,0,0,1|2,0,0]=4 5081 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)F 527a_100000199005_100000749702 [0,1,0,0,0,1|2,0,0]=4 5082 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100000749702 [0,1,0,0,0,1|2,0,0]=4 5083 B16R1.8 C=CCCC(=O)NCCc1ccc(cc1)O 527a_100000743037_100000749702 [0,1,0,0,0,1|2,0,0]=4 5084 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Br 1626a_100020586998_100011236545 [0,1,0,0,0,1|2,0,0]=4 5085 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Br 240690a_100020586998_100011236545 [0,1,0,0,0,1|2,0,0]=4 5086 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Br 527a_100020586998_100011236545 [0,1,0,0,0,1|2,0,0]=4 5087 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)C 1626a_100020586998_100000741418 [0,1,0,0,0,1|2,0,0]=4 5088 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)C 240690a_100020586998_100000741418 [0,1,0,0,0,1|2,0,0]=4 5089 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)C 527a_100020586998_100000741418 [0,1,0,0,0,1|2,0,0]=4 5090 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Cl 1626a_100020586998_100000741339 [0,1,0,0,0,1|2,0,0]=4 5091 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Cl 240690a_100020586998_100000741339 [0,1,0,0,0,1|2,0,0]=4 5092 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)Cl 527a_100020586998_100000741339 [0,1,0,0,0,1|2,0,0]=4 5093 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)F 1626a_100020586998_100011219804 [0,1,0,0,0,1|2,0,0]=4 5094 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)F 240690a_100020586998_100011219804 [0,1,0,0,0,1|2,0,0]=4 5095 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)F 527a_100020586998_100011219804 [0,1,0,0,0,1|2,0,0]=4 5096 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)I 1626a_100020586998_100011236544 [0,1,0,0,0,1|2,0,0]=4 5097 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)I 240690a_100020586998_100011236544 [0,1,0,0,0,1|2,0,0]=4 5098 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)I 527a_100020586998_100011236544 [0,1,0,0,0,1|2,0,0]=4 5099 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)O 240690a_100020586998_100000116853 [0,1,0,0,0,1|2,0,0]=4 5100 B16R1.8 C=CCNC(=O)CCCc1ccc(cc1)O 527a_100020586998_100000116853 [0,1,0,0,0,1|2,0,0]=4 5101 B16R1.8 C=CCNC(=O)CCNc1ccc(cc1)Br 2230a_100000210018_100011222895 [0,1,0,0,0,1|2,0,0]=4 5102 B16R1.8 C=CCNC(=O)CCNc1ccc(cc1)Cl 2230a_100000210052_100011222895 [0,1,0,0,0,1|2,0,0]=4 5103 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)Br 240690a_100020586998_100000738328 [0,1,0,0,0,1|1,0,0]=3 5104 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)Br 7a_100000185759_100011222895 [0,1,0,0,0,1|1,0,0]=3 5105 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)C 1626a_100020586998_100000182323 [0,1,0,0,0,1|1,0,0]=3 5106 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)C 240690a_100020586998_100000182323 [0,1,0,0,0,1|1,0,0]=3 5107 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)C 7a_100000210336_100011222895 [0,1,0,0,0,1|1,0,0]=3 5108 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)Cl 1626a_100020586998_100000186438 [0,1,0,0,0,1|1,0,0]=3 5109 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)Cl 240690a_100020586998_100000186438 [0,1,0,0,0,1|1,0,0]=3 5110 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)Cl 7a_100000210216_100011222895 [0,1,0,0,0,1|1,0,0]=3 5111 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)F 1626a_100020586998_100000737396 [0,1,0,0,0,1|1,0,0]=3 5112 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)F 240690a_100020586998_100000737396 [0,1,0,0,0,1|1,0,0]=3 5113 B16R1.8 C=CCNC(=O)CCOc1ccc(cc1)I 7a_100000212066_100011222895 [0,1,0,0,0,1|1,0,0]=3 5114 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)Br 7a_100000685995_100011222895 [0,1,0,0,0,1|2,0,0]=4 5115 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)C 7a_100000745506_100011222895 [0,1,0,0,0,1|2,0,0]=4 5116 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)Cl 7a_100000744096_100011222895 [0,1,0,0,0,1|2,0,0]=4 5117 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)F 7a_100000688820_100011222895 [0,1,0,0,0,1|2,0,0]=4 5118 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)I 7a_100000687607_100011222895 [0,1,0,0,0,1|2,0,0]=4 5119 B16R1.8 C=CCNC(=O)CCOc1ccc(nc1)N 7a_100015188713_100011222895 [0,1,0,0,0,1|2,0,0]=4 5120 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Br 240690a_100020586998_100000208627 [0,1,0,0,0,1|1,1,0]=4 5121 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Br 527a_100020586998_100000208627 [0,1,0,0,0,1|1,1,0]=4 5122 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Br 62a_100000752885_100011222895 [0,1,0,0,0,1|1,1,0]=4 5123 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Br 62a_100011222895_100000752885 [0,1,0,0,0,1|1,1,0]=4 5124 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)C 1626a_100020586998_100000182377 [0,1,0,0,0,1|1,1,0]=4 5125 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)C 240690a_100020586998_100000182377 [0,1,0,0,0,1|1,1,0]=4 5126 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)C 62a_100000186775_100011222895 [0,1,0,0,0,1|1,1,0]=4 5127 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)C 62a_100011222895_100000186775 [0,1,0,0,0,1|1,1,0]=4 5128 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Cl 1626a_100020586998_100000182369 [0,1,0,0,0,1|1,1,0]=4 5129 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Cl 240690a_100020586998_100000182369 [0,1,0,0,0,1|1,1,0]=4 5130 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Cl 527a_100020586998_100000182369 [0,1,0,0,0,1|1,1,0]=4 5131 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Cl 62a_100000755918_100011222895 [0,1,0,0,0,1|1,1,0]=4 5132 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)Cl 62a_100011222895_100000755918 [0,1,0,0,0,1|1,1,0]=4 5133 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)F 1626a_100020586998_100000199091 [0,1,0,0,0,1|1,1,0]=4 5134 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)F 240690a_100020586998_100000199091 [0,1,0,0,0,1|1,1,0]=4 5135 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)F 527a_100020586998_100000199091 [0,1,0,0,0,1|1,1,0]=4 5136 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)F 62a_100000211213_100011222895 [0,1,0,0,0,1|1,1,0]=4 5137 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)F 62a_100011222895_100000211213 [0,1,0,0,0,1|1,1,0]=4 5138 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)N 62a_100000185761_100011222895 [0,1,0,0,0,1|1,1,0]=4 5139 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)N 62a_100011222895_100000185761 [0,1,0,0,0,1|1,1,0]=4 5140 B16R1.8 C=CCNC(=O)CCSc1ccc(cc1)O 62a_100011222895_100000185759 [0,1,0,0,0,1|1,1,0]=4 5141 B16R1.8 C=CCNC(=O)CNCc1ccc(cc1)Br 2230a_100000174875_100000183597 [0,1,0,0,0,1|2,0,0]=4 5142 B16R1.8 C=CCNC(=O)CNCc1ccc(cc1)C 2230a_100000174908_100000183597 [0,1,0,0,0,1|2,0,0]=4 5143 B16R1.8 C=CCNC(=O)CNCc1ccc(cc1)Cl 2230a_100000174871_100000183597 [0,1,0,0,0,1|2,0,0]=4 5144 B16R1.8 C=CCNC(=O)CNCc1ccc(cc1)F 2230a_100000174882_100000183597 [0,1,0,0,0,1|2,0,0]=4 5145 B16R1.8 C=CCNC(=O)CNCc1ccc(cc1)I 2230a_100016989417_100000183597 [0,1,0,0,0,1|2,0,0]=4 5146 B16R1.8 C=CCNC(=O)COCc1cc[n+](cc1)[O-] 7a_100000031831_100000183597 [0,1,0,0,0,1|2,0,0]=4 5147 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)Br 1626a_100020586998_200012349173 [0,1,0,0,0,1|1,0,0]=3 5148 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)Br 527a_100020586998_200012349173 [0,1,0,0,0,1|1,0,0]=3 5149 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)C 7a_100011215236_100000183597 [0,1,0,0,0,1|1,0,0]=3 5150 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)Cl 7a_100000211118_100000183597 [0,1,0,0,0,1|1,0,0]=3 5151 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)F 7a_100000210977_100000183597 [0,1,0,0,0,1|1,0,0]=3 5152 B16R1.8 C=CCNC(=O)COCc1ccc(cc1)I 7a_100000690907_100000183597 [0,1,0,0,0,1|1,0,0]=3 5153 B16R1.8 C=CCNC(=O)COCc1ccc(nc1)Br 7a_100009816760_100000183597 [0,1,0,0,0,1|2,0,0]=4 5154 B16R1.8 C=CCNC(=O)COCc1ccc(nc1)Cl 7a_100000755211_100000183597 [0,1,0,0,0,1|2,0,0]=4 5155 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Br 1626a_100020586998_100000150267 [0,1,0,0,0,1|1,1,0]=4 5156 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Br 240690a_100020586998_100000150267 [0,1,0,0,0,1|1,1,0]=4 5157 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Br 527a_100020586998_100000150267 [0,1,0,0,0,1|1,1,0]=4 5158 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Br 62a_100000183597_100000189115 [0,1,0,0,0,1|1,1,0]=4 5159 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Br 62a_100000189115_100000183597 [0,1,0,0,0,1|1,1,0]=4 5160 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)C 62a_100000183597_100000210814 [0,1,0,0,0,1|1,1,0]=4 5161 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)C 62a_100000210814_100000183597 [0,1,0,0,0,1|1,1,0]=4 5162 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Cl 1626a_100020586998_100000150262 [0,1,0,0,0,1|1,1,0]=4 5163 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Cl 240690a_100020586998_100000150262 [0,1,0,0,0,1|1,1,0]=4 5164 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Cl 527a_100020586998_100000150262 [0,1,0,0,0,1|1,1,0]=4 5165 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Cl 62a_100000183597_100000187161 [0,1,0,0,0,1|1,1,0]=4 5166 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)Cl 62a_100000187161_100000183597 [0,1,0,0,0,1|1,1,0]=4 5167 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)F 1626a_100020586998_100000150272 [0,1,0,0,0,1|1,1,0]=4 5168 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)F 240690a_100020586998_100000150272 [0,1,0,0,0,1|1,1,0]=4 5169 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)F 527a_100020586998_100000150272 [0,1,0,0,0,1|1,1,0]=4 5170 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)F 62a_100000183597_100000187164 [0,1,0,0,0,1|1,1,0]=4 5171 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)F 62a_100000198546_100000183597 [0,1,0,0,0,1|1,1,0]=4 5172 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)I 62a_100000183597_100000189116 [0,1,0,0,0,1|1,1,0]=4 5173 B16R1.8 C=CCNC(=O)CSCc1ccc(cc1)I 62a_100000189116_100000183597 [0,1,0,0,0,1|1,1,0]=4 5174 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Br 2708a_100000755846_100020586998 [0,1,0,0,0,1|2,0,0]=4 5175 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Br 273464a_100000755846_100020586998 [0,1,0,0,0,1|2,0,0]=4 5176 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Br 273464a_100020586998_100000755846 [0,1,0,0,0,1|2,0,0]=4 5177 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Br 512a_100000755846_100020586998 [0,1,0,0,0,1|2,0,0]=4 5178 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Br 512a_100020586998_100000755846 [0,1,0,0,0,1|2,0,0]=4 5179 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)C 2708a_100000705350_100020586998 [0,1,0,0,0,1|2,0,0]=4 5180 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)C 273464a_100000705350_100020586998 [0,1,0,0,0,1|2,0,0]=4 5181 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)C 273464a_100020586998_100000705350 [0,1,0,0,0,1|2,0,0]=4 5182 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)C 512a_100000705350_100020586998 [0,1,0,0,0,1|2,0,0]=4 5183 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)C 512a_100020586998_100000705350 [0,1,0,0,0,1|2,0,0]=4 5184 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Cl 2708a_100000185265_100020586998 [0,1,0,0,0,1|2,0,0]=4 5185 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Cl 273464a_100000185265_100020586998 [0,1,0,0,0,1|2,0,0]=4 5186 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Cl 273464a_100020586998_100000185265 [0,1,0,0,0,1|2,0,0]=4 5187 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Cl 512a_100000185265_100020586998 [0,1,0,0,0,1|2,0,0]=4 5188 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)Cl 512a_100020586998_100000185265 [0,1,0,0,0,1|2,0,0]=4 5189 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)F 2708a_100000199005_100020586998 [0,1,0,0,0,1|2,0,0]=4 5190 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)F 273464a_100000199005_100020586998 [0,1,0,0,0,1|2,0,0]=4 5191 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)F 273464a_100020586998_100000199005 [0,1,0,0,0,1|2,0,0]=4 5192 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)F 512a_100000199005_100020586998 [0,1,0,0,0,1|2,0,0]=4 5193 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)F 512a_100020586998_100000199005 [0,1,0,0,0,1|2,0,0]=4 5194 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)O 2708a_100000743037_100020586998 [0,1,0,0,0,1|2,0,0]=4 5195 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)O 273464a_100000743037_100020586998 [0,1,0,0,0,1|2,0,0]=4 5196 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)O 273464a_100020586998_100000743037 [0,1,0,0,0,1|2,0,0]=4 5197 B16R1.8 C=CCNC(=O)NCCc1ccc(cc1)O 512a_100020586998_100000743037 [0,1,0,0,0,1|2,0,0]=4 5198 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)Br 2230a_100000174875_100000033060 [0,1,0,0,0,1|1,0,0]=3 5199 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)Br 34a_100000174875_100000033060 [0,1,0,0,0,1|1,0,0]=3 5200 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)C 2230a_100000174908_100000033060 [0,1,0,0,0,1|1,0,0]=3 5201 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)C 34a_100000174908_100000033060 [0,1,0,0,0,1|1,0,0]=3 5202 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)Cl 2230a_100000174871_100000033060 [0,1,0,0,0,1|1,0,0]=3 5203 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)Cl 34a_100000174871_100000033060 [0,1,0,0,0,1|1,0,0]=3 5204 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)F 2230a_100000174882_100000033060 [0,1,0,0,0,1|1,0,0]=3 5205 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)F 34a_100000174882_100000033060 [0,1,0,0,0,1|1,0,0]=3 5206 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)I 2230a_100016989417_100000033060 [0,1,0,0,0,1|1,0,0]=3 5207 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)I 34a_100016989417_100000033060 [0,1,0,0,0,1|1,0,0]=3 5208 B16R1.8 C=CCOC(=O)CNCc1ccc(cc1)O 34a_100000185549_100000033060 [0,1,0,0,0,1|1,0,0]=3 5209 B16R1.8 C=CCOC(=O)CNCc1ccc(cn1)Br 34a_100015188789_100000033060 [0,1,0,0,0,1|2,0,0]=4 5210 B16R1.8 C=CCOC(=O)CNCc1ccc(cn1)C 34a_100015187455_100000033060 [0,1,0,0,0,1|2,0,0]=4 5211 B16R1.8 C=CCOC(=O)CNCc1ccc(cn1)Cl 34a_100000697193_100000033060 [0,1,0,0,0,1|2,0,0]=4 5212 B16R1.8 C=CCOC(=O)CNCc1ccc(cn1)F 34a_100020620131_100000033060 [0,1,0,0,0,1|2,0,0]=4 5213 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)Br 2230a_100009817727_100000033060 [0,1,0,0,0,1|2,0,0]=4 5214 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)Br 34a_100009817727_100000033060 [0,1,0,0,0,1|2,0,0]=4 5215 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)C 34a_100000740942_100000033060 [0,1,0,0,0,1|2,0,0]=4 5216 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)Cl 2230a_100000735879_100000033060 [0,1,0,0,0,1|2,0,0]=4 5217 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)Cl 34a_100000735879_100000033060 [0,1,0,0,0,1|2,0,0]=4 5218 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)F 2230a_100000101913_100000033060 [0,1,0,0,0,1|2,0,0]=4 5219 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)F 34a_100000101913_100000033060 [0,1,0,0,0,1|2,0,0]=4 5220 B16R1.8 C=CCOC(=O)CNCc1ccc(nc1)O 2230a_100000757128_100000033060 [0,1,0,0,0,1|2,0,0]=4 5221 B16R1.8 C=CCOC(=O)COCc1cc[n+](cc1)C 34a_100009831711_100000033060 [0,1,0,0,0,1|1,0,0]=3 5222 B16R1.8 C=CCOC(=O)COCc1cc[n+](cc1)[O-] 34a_100000031831_100000033060 [0,1,0,0,0,1|1,0,0]=3 5223 B16R1.8 C=CCOC(=O)COCc1cc[n+](cc1)[O-] 7a_100000031831_100000033060 [0,1,0,0,0,1|1,0,0]=3 5224 B16R1.8 C=CCOC(=O)COCc1ccc(=O)[nH]c1 34a_100011999846_100000033060 [0,1,0,0,0,1|1,0,0]=3 5225 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)Br 34a_100000695286_100000033060 [0,1,0,0,0,1|0,0,0]=2 5226 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)C 34a_100011215236_100000033060 [0,1,0,0,0,1|0,0,0]=2 5227 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)C 7a_100011215236_100000033060 [0,1,0,0,0,1|0,0,0]=2 5228 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)Cl 34a_100000211118_100000033060 [0,1,0,0,0,1|0,0,0]=2 5229 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)Cl 7a_100000211118_100000033060 [0,1,0,0,0,1|0,0,0]=2 5230 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)F 34a_100000210977_100000033060 [0,1,0,0,0,1|0,0,0]=2 5231 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)F 7a_100000210977_100000033060 [0,1,0,0,0,1|0,0,0]=2 5232 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)I 34a_100000690907_100000033060 [0,1,0,0,0,1|0,0,0]=2 5233 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)I 7a_100000690907_100000033060 [0,1,0,0,0,1|0,0,0]=2 5234 B16R1.8 C=CCOC(=O)COCc1ccc(cc1)N 34a_100011215238_100000033060 [0,1,0,0,0,1|0,0,0]=2 5235 B16R1.8 C=CCOC(=O)COCc1ccc(cn1)Br 34a_100000754261_100000033060 [0,1,0,0,0,1|1,0,0]=3 5236 B16R1.8 C=CCOC(=O)COCc1ccc(cn1)C 34a_100012001401_100000033060 [0,1,0,0,0,1|1,0,0]=3 5237 B16R1.8 C=CCOC(=O)COCc1ccc(cn1)Cl 34a_100000703999_100000033060 [0,1,0,0,0,1|1,0,0]=3 5238 B16R1.8 C=CCOC(=O)COCc1ccc(cn1)F 34a_100011999454_100000033060 [0,1,0,0,0,1|1,0,0]=3 5239 B16R1.8 C=CCOC(=O)COCc1ccc(cn1)N 34a_100011998161_100000033060 [0,1,0,0,0,1|1,0,0]=3 5240 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)Br 34a_100009816760_100000033060 [0,1,0,0,0,1|1,0,0]=3 5241 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)Br 7a_100009816760_100000033060 [0,1,0,0,0,1|1,0,0]=3 5242 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)C 34a_100011248133_100000033060 [0,1,0,0,0,1|1,0,0]=3 5243 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)Cl 34a_100000755211_100000033060 [0,1,0,0,0,1|1,0,0]=3 5244 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)Cl 7a_100000755211_100000033060 [0,1,0,0,0,1|1,0,0]=3 5245 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)F 34a_100000079959_100000033060 [0,1,0,0,0,1|1,0,0]=3 5246 B16R1.8 C=CCOC(=O)COCc1ccc(nc1)N 34a_100000704267_100000033060 [0,1,0,0,0,1|1,0,0]=3 5247 B16R1.8 C=CCOC(=O)COCc1cnc(cn1)C 34a_100011273949_100000033060 [0,1,0,0,0,1|2,0,0]=4 5248 B16R1.8 C=CCOC(=O)COCc1cnc(cn1)Cl 34a_100012002382_100000033060 [0,1,0,0,0,1|2,0,0]=4 5249 B16R1.8 C=CCOC(=O)COCc1cnc(nc1)C 34a_100011746891_100000033060 [0,1,0,0,0,1|2,0,0]=4 5250 B16R1.8 C=CCOC(=O)COCc1cnc(nc1)Cl 34a_100009855073_100000033060 [0,1,0,0,0,1|2,0,0]=4 5251 B16R1.8 C=CCOC(=O)COCc1cnc(nc1)Cl 7a_100009855073_100000033060 [0,1,0,0,0,1|2,0,0]=4 5252 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)Br 62a_100000033060_100000189115 [0,1,0,0,0,1|0,1,0]=3 5253 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)Br 62a_100000189115_100000033060 [0,1,0,0,0,1|0,1,0]=3 5254 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)C 62a_100000033060_100000210814 [0,1,0,0,0,1|0,1,0]=3 5255 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)C 62a_100000210814_100000033060 [0,1,0,0,0,1|0,1,0]=3 5256 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)Cl 62a_100000033060_100000187161 [0,1,0,0,0,1|0,1,0]=3 5257 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)Cl 62a_100000187161_100000033060 [0,1,0,0,0,1|0,1,0]=3 5258 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)F 62a_100000033060_100000187164 [0,1,0,0,0,1|0,1,0]=3 5259 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)F 62a_100000198546_100000033060 [0,1,0,0,0,1|0,1,0]=3 5260 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)I 62a_100000033060_100000189116 [0,1,0,0,0,1|0,1,0]=3 5261 B16R1.8 C=CCOC(=O)CSCc1ccc(cc1)I 62a_100000189116_100000033060 [0,1,0,0,0,1|0,1,0]=3 5262 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)Br 62a_100000033060_100000702658 [0,1,0,0,0,1|1,1,0]=4 5263 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)Br 62a_100000702658_100000033060 [0,1,0,0,0,1|1,1,0]=4 5264 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)C 62a_100000033060_100000691093 [0,1,0,0,0,1|1,1,0]=4 5265 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)C 62a_100000691093_100000033060 [0,1,0,0,0,1|1,1,0]=4 5266 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)Cl 62a_100000033060_100000697101 [0,1,0,0,0,1|1,1,0]=4 5267 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)Cl 62a_100012066911_100000033060 [0,1,0,0,0,1|1,1,0]=4 5268 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)F 62a_100000033060_100000703193 [0,1,0,0,0,1|1,1,0]=4 5269 B16R1.8 C=CCOC(=O)CSCc1ccc(cn1)F 62a_100000703193_100000033060 [0,1,0,0,0,1|1,1,0]=4 5270 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)Br 62a_100000033060_100009831999 [0,1,0,0,0,1|1,1,0]=4 5271 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)Br 62a_100009831999_100000033060 [0,1,0,0,0,1|1,1,0]=4 5272 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)C 62a_100000033060_100016987292 [0,1,0,0,0,1|1,1,0]=4 5273 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)C 62a_100016987292_100000033060 [0,1,0,0,0,1|1,1,0]=4 5274 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)Cl 62a_100000033060_100000735431 [0,1,0,0,0,1|1,1,0]=4 5275 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)Cl 62a_100000735431_100000033060 [0,1,0,0,0,1|1,1,0]=4 5276 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)F 62a_100000033060_100000099788 [0,1,0,0,0,1|1,1,0]=4 5277 B16R1.8 C=CCOC(=O)CSCc1ccc(nc1)F 62a_100009820150_100000033060 [0,1,0,0,0,1|1,1,0]=4 5278 B16R1.8 CCCOC(=O)COCc1ccc(cc1)Br 34a_100000695286_200011215008 [0,1,0,0,0,1|0,0,2]=4 5279 B16R1.8 CCCOC(=O)COCc1ccc(cc1)C 34a_100011215236_200011215008 [0,1,0,0,0,1|0,0,2]=4 5280 B16R1.8 CCCOC(=O)COCc1ccc(cc1)C 7a_100011215236_200011215008 [0,1,0,0,0,1|0,0,2]=4 5281 B16R1.8 CCCOC(=O)COCc1ccc(cc1)Cl 34a_100000211118_200011215008 [0,1,0,0,0,1|0,0,2]=4 5282 B16R1.8 CCCOC(=O)COCc1ccc(cc1)Cl 7a_100000211118_200011215008 [0,1,0,0,0,1|0,0,2]=4 5283 B16R1.8 CCCOC(=O)COCc1ccc(cc1)F 34a_100000210977_200011215008 [0,1,0,0,0,1|0,0,2]=4 5284 B16R1.8 CCCOC(=O)COCc1ccc(cc1)F 7a_100000210977_200011215008 [0,1,0,0,0,1|0,0,2]=4 5285 B16R1.8 CCCOC(=O)COCc1ccc(cc1)I 34a_100000690907_200011215008 [0,1,0,0,0,1|0,0,2]=4 5286 B16R1.8 CCCOC(=O)COCc1ccc(cc1)I 7a_100000690907_200011215008 [0,1,0,0,0,1|0,0,2]=4 5287 B16R1.8 CCCOC(=O)COCc1ccc(cc1)N 34a_100011215238_200011215008 [0,1,0,0,0,1|0,0,2]=4 5288 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)Br 34a_100000185759_200000139673 [0,1,0,0,0,1|0,0,2]=4 5289 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)Br 7a_100000185759_200000139673 [0,1,0,0,0,1|0,0,2]=4 5290 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)C 34a_100000210336_200000139673 [0,1,0,0,0,1|0,0,2]=4 5291 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)C 7a_100000210336_200000139673 [0,1,0,0,0,1|0,0,2]=4 5292 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)Cl 34a_100000210216_200000139673 [0,1,0,0,0,1|0,0,2]=4 5293 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)Cl 7a_100000210216_200000139673 [0,1,0,0,0,1|0,0,2]=4 5294 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)F 34a_100000210339_200000139673 [0,1,0,0,0,1|0,0,2]=4 5295 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)I 34a_100000212066_200000139673 [0,1,0,0,0,1|0,0,2]=4 5296 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)I 7a_100000212066_200000139673 [0,1,0,0,0,1|0,0,2]=4 5297 B16R1.8 CCCOC(=O)OCOc1ccc(cc1)N 34a_100000185829_200000139673 [0,1,0,0,0,1|0,0,2]=4 5298 B16R1.119 C=CC=CC(=O)CCOc1cccc(c1)Br 1458a_100016291481_100000183150 [0,1,0,0,0,1|1,0,1]=4 5299 B16R1.119 C=CC=CC(=O)CCOc1cccc(c1)Cl 1458a_100016291481_100000181161 [0,1,0,0,0,1|1,0,1]=4 5300 B16R1.119 C=CC=CC(=O)CCOc1cccc(c1)F 1458a_100016291481_100000739188 [0,1,0,0,0,1|1,0,1]=4 5301 B16R1.119 C=CCCC(=O)CC#Cc1cccc(c1)Br 1458a_100000749702_100010706776 [0,1,0,0,0,1|2,0,0]=4 5302 B16R1.119 C=CCCC(=O)CC#Cc1cccc(c1)F 1458a_100000749702_100010402994 [0,1,0,0,0,1|2,0,0]=4 5303 B16R1.119 C=CCCC(=O)CCCc1cccc(c1)Br 1458a_100000685939_100000754431 [0,1,0,0,0,1|2,0,0]=4 5304 B16R1.119 C=CCCC(=O)CCCc1cccc(c1)Br 1458a_100000749702_100011713683 [0,1,0,0,0,1|2,0,0]=4 5305 B16R1.119 C=CCCC(=O)CCCc1cccc(c1)F 1458a_100000749702_200000698031 [0,1,0,0,0,1|2,0,0]=4 5306 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)Br 1458a_100000183437_100000754431 [0,1,0,0,0,1|1,0,0]=3 5307 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)Br 1458a_100000749702_100000183150 [0,1,0,0,0,1|1,0,0]=3 5308 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)C 1458a_100000182325_100000754431 [0,1,0,0,0,1|1,0,0]=3 5309 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)Cl 1458a_100000738917_100000754431 [0,1,0,0,0,1|1,0,0]=3 5310 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)Cl 1458a_100000749702_100000181161 [0,1,0,0,0,1|1,0,0]=3 5311 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)F 1458a_100000737089_100000754431 [0,1,0,0,0,1|1,0,0]=3 5312 B16R1.119 C=CCCC(=O)CCOc1cccc(c1)F 1458a_100000749702_100000739188 [0,1,0,0,0,1|1,0,0]=3 5313 B16R1.119 C=CCCC(=O)CSCc1cccc(c1)Cl 1458a_100000150269_100000754431 [0,1,0,0,0,1|1,1,0]=4 5314 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Br 11a_100011207229_100000749702 [0,1,0,0,0,1|2,0,0]=4 5315 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Br 1626a_100011207229_100000749702 [0,1,0,0,0,1|2,0,0]=4 5316 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Br 240690a_100011207229_100000749702 [0,1,0,0,0,1|2,0,0]=4 5317 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Br 527a_100011207229_100000749702 [0,1,0,0,0,1|2,0,0]=4 5318 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)C 11a_100000749837_100000749702 [0,1,0,0,0,1|2,0,0]=4 5319 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)C 1626a_100000749837_100000749702 [0,1,0,0,0,1|2,0,0]=4 5320 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)C 240690a_100000749837_100000749702 [0,1,0,0,0,1|2,0,0]=4 5321 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)C 527a_100000749837_100000749702 [0,1,0,0,0,1|2,0,0]=4 5322 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Cl 11a_100000185263_100000749702 [0,1,0,0,0,1|2,0,0]=4 5323 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Cl 1626a_100000185263_100000749702 [0,1,0,0,0,1|2,0,0]=4 5324 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Cl 240690a_100000185263_100000749702 [0,1,0,0,0,1|2,0,0]=4 5325 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)Cl 527a_100000185263_100000749702 [0,1,0,0,0,1|2,0,0]=4 5326 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)F 11a_100000205154_100000749702 [0,1,0,0,0,1|2,0,0]=4 5327 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)F 1626a_100000205154_100000749702 [0,1,0,0,0,1|2,0,0]=4 5328 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)F 240690a_100000205154_100000749702 [0,1,0,0,0,1|2,0,0]=4 5329 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)F 527a_100000205154_100000749702 [0,1,0,0,0,1|2,0,0]=4 5330 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)O 240690a_100000747277_100000749702 [0,1,0,0,0,1|2,0,0]=4 5331 B16R1.119 C=CCCC(=O)NCCc1cccc(c1)O 527a_100000747277_100000749702 [0,1,0,0,0,1|2,0,0]=4 5332 B16R1.119 C=CCNC(=O)CCCc1cccc(c1)Br 1626a_100020586998_100000685939 [0,1,0,0,0,1|2,0,0]=4 5333 B16R1.119 C=CCNC(=O)CCCc1cccc(c1)Br 240690a_100020586998_100000685939 [0,1,0,0,0,1|2,0,0]=4 5334 B16R1.119 C=CCNC(=O)CCCc1cccc(c1)Br 527a_100020586998_100000685939 [0,1,0,0,0,1|2,0,0]=4 5335 B16R1.119 C=CCNC(=O)CCNc1cccc(c1)C 2230a_100000188690_100011222895 [0,1,0,0,0,1|2,0,0]=4 5336 B16R1.119 C=CCNC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100011222895 [0,1,0,0,0,1|2,0,0]=4 5337 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)Br 240690a_100020586998_100000183437 [0,1,0,0,0,1|1,0,0]=3 5338 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)Br 7a_100000210342_100011222895 [0,1,0,0,0,1|1,0,0]=3 5339 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)C 1626a_100020586998_100000182325 [0,1,0,0,0,1|1,0,0]=3 5340 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)C 240690a_100020586998_100000182325 [0,1,0,0,0,1|1,0,0]=3 5341 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)C 7a_100000210337_100011222895 [0,1,0,0,0,1|1,0,0]=3 5342 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)Cl 1626a_100020586998_100000738917 [0,1,0,0,0,1|1,0,0]=3 5343 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)Cl 240690a_100020586998_100000738917 [0,1,0,0,0,1|1,0,0]=3 5344 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100011222895 [0,1,0,0,0,1|1,0,0]=3 5345 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)F 1626a_100020586998_100000737089 [0,1,0,0,0,1|1,0,0]=3 5346 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)F 240690a_100020586998_100000737089 [0,1,0,0,0,1|1,0,0]=3 5347 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)F 7a_100000210426_100011222895 [0,1,0,0,0,1|1,0,0]=3 5348 B16R1.119 C=CCNC(=O)CCOc1cccc(c1)I 7a_100000211634_100011222895 [0,1,0,0,0,1|1,0,0]=3 5349 B16R1.119 C=CCNC(=O)CCOc1cncc(c1)Br 7a_100000754920_100011222895 [0,1,0,0,0,1|2,0,0]=4 5350 B16R1.119 C=CCNC(=O)CCOc1cncc(c1)C 7a_100011830280_100011222895 [0,1,0,0,0,1|2,0,0]=4 5351 B16R1.119 C=CCNC(=O)CCOc1cncc(c1)Cl 7a_100000032511_100011222895 [0,1,0,0,0,1|2,0,0]=4 5352 B16R1.119 C=CCNC(=O)CCOc1cncc(c1)F 7a_100011830296_100011222895 [0,1,0,0,0,1|2,0,0]=4 5353 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)Br 62a_100000691529_100011222895 [0,1,0,0,0,1|1,1,0]=4 5354 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)Br 62a_100011222895_100000691529 [0,1,0,0,0,1|1,1,0]=4 5355 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)C 62a_100011215228_100011222895 [0,1,0,0,0,1|1,1,0]=4 5356 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)C 62a_100011222895_100011215228 [0,1,0,0,0,1|1,1,0]=4 5357 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100011222895 [0,1,0,0,0,1|1,1,0]=4 5358 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)Cl 62a_100011222895_100000699651 [0,1,0,0,0,1|1,1,0]=4 5359 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)F 62a_100000685547_100011222895 [0,1,0,0,0,1|1,1,0]=4 5360 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)F 62a_100011222895_100000685547 [0,1,0,0,0,1|1,1,0]=4 5361 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)N 62a_100000210019_100011222895 [0,1,0,0,0,1|1,1,0]=4 5362 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)N 62a_100011222895_100000210019 [0,1,0,0,0,1|1,1,0]=4 5363 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)O 62a_100011222895_100000211634 [0,1,0,0,0,1|1,1,0]=4 5364 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)[S] 62a_100011222895_114929384022 [0,1,0,0,0,1|1,1,0]=4 5365 B16R1.119 C=CCNC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100011222895 [0,1,0,0,0,1|1,1,0]=4 5366 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)Br 2230a_100000174977_100000183597 [0,1,0,0,0,1|2,0,0]=4 5367 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)C 2230a_100000185548_100000183597 [0,1,0,0,0,1|2,0,0]=4 5368 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)Cl 2230a_100000174878_100000183597 [0,1,0,0,0,1|2,0,0]=4 5369 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)F 2230a_100000174948_100000183597 [0,1,0,0,0,1|2,0,0]=4 5370 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)I 2230a_100000106179_100000183597 [0,1,0,0,0,1|2,0,0]=4 5371 B16R1.119 C=CCNC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000183597 [0,1,0,0,0,1|2,0,0]=4 5372 B16R1.119 C=CCNC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000183597 [0,1,0,0,0,1|2,0,0]=4 5373 B16R1.119 C=CCNC(=O)COCc1cccc(c1)Br 7a_100000687537_100000183597 [0,1,0,0,0,1|1,0,0]=3 5374 B16R1.119 C=CCNC(=O)COCc1cccc(c1)C 7a_100011217746_100000183597 [0,1,0,0,0,1|1,0,0]=3 5375 B16R1.119 C=CCNC(=O)COCc1cccc(c1)Cl 7a_100000241301_100000183597 [0,1,0,0,0,1|1,0,0]=3 5376 B16R1.119 C=CCNC(=O)COCc1cccc(c1)F 7a_100000210976_100000183597 [0,1,0,0,0,1|1,0,0]=3 5377 B16R1.119 C=CCNC(=O)COCc1cccc(c1)I 7a_100011215336_100000183597 [0,1,0,0,0,1|1,0,0]=3 5378 B16R1.119 C=CCNC(=O)COCc1ccnc(c1)Br 7a_100009814636_100000183597 [0,1,0,0,0,1|2,0,0]=4 5379 B16R1.119 C=CCNC(=O)COCc1cncc(c1)Br 7a_100011259137_100000183597 [0,1,0,0,0,1|2,0,0]=4 5380 B16R1.119 C=CCNC(=O)COCc1cncc(c1)C 7a_100011998709_100000183597 [0,1,0,0,0,1|2,0,0]=4 5381 B16R1.119 C=CCNC(=O)COCc1cncc(c1)Cl 7a_100000092867_100000183597 [0,1,0,0,0,1|2,0,0]=4 5382 B16R1.119 C=CCNC(=O)COCc1cncc(c1)F 7a_100011962875_100000183597 [0,1,0,0,0,1|2,0,0]=4 5383 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Br 62a_100000183597_100000211773 [0,1,0,0,0,1|1,1,0]=4 5384 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Br 62a_100000211773_100000183597 [0,1,0,0,0,1|1,1,0]=4 5385 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)C 62a_100000183597_100000211840 [0,1,0,0,0,1|1,1,0]=4 5386 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)C 62a_100000211840_100000183597 [0,1,0,0,0,1|1,1,0]=4 5387 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Cl 1626a_100020586998_100000150269 [0,1,0,0,0,1|1,1,0]=4 5388 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Cl 240690a_100020586998_100000150269 [0,1,0,0,0,1|1,1,0]=4 5389 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Cl 527a_100020586998_100000150269 [0,1,0,0,0,1|1,1,0]=4 5390 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Cl 62a_100000183597_100000187163 [0,1,0,0,0,1|1,1,0]=4 5391 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)Cl 62a_100000187163_100000183597 [0,1,0,0,0,1|1,1,0]=4 5392 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)F 62a_100000183597_100000230114 [0,1,0,0,0,1|1,1,0]=4 5393 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)F 62a_100000230114_100000183597 [0,1,0,0,0,1|1,1,0]=4 5394 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)I 62a_100000183597_100011218688 [0,1,0,0,0,1|1,1,0]=4 5395 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)I 62a_100011218688_100000183597 [0,1,0,0,0,1|1,1,0]=4 5396 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)O 62a_100000183597_100011660834 [0,1,0,0,0,1|1,1,0]=4 5397 B16R1.119 C=CCNC(=O)CSCc1cccc(c1)O 62a_100011660834_100000183597 [0,1,0,0,0,1|1,1,0]=4 5398 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Br 2708a_100011207229_100020586998 [0,1,0,0,0,1|2,0,0]=4 5399 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Br 273464a_100011207229_100020586998 [0,1,0,0,0,1|2,0,0]=4 5400 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Br 273464a_100020586998_100011207229 [0,1,0,0,0,1|2,0,0]=4 5401 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Br 512a_100011207229_100020586998 [0,1,0,0,0,1|2,0,0]=4 5402 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Br 512a_100020586998_100011207229 [0,1,0,0,0,1|2,0,0]=4 5403 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)C 2708a_100000749837_100020586998 [0,1,0,0,0,1|2,0,0]=4 5404 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)C 273464a_100000749837_100020586998 [0,1,0,0,0,1|2,0,0]=4 5405 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)C 273464a_100020586998_100000749837 [0,1,0,0,0,1|2,0,0]=4 5406 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)C 512a_100000749837_100020586998 [0,1,0,0,0,1|2,0,0]=4 5407 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)C 512a_100020586998_100000749837 [0,1,0,0,0,1|2,0,0]=4 5408 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Cl 2708a_100000185263_100020586998 [0,1,0,0,0,1|2,0,0]=4 5409 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Cl 273464a_100000185263_100020586998 [0,1,0,0,0,1|2,0,0]=4 5410 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Cl 273464a_100020586998_100000185263 [0,1,0,0,0,1|2,0,0]=4 5411 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Cl 512a_100000185263_100020586998 [0,1,0,0,0,1|2,0,0]=4 5412 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)Cl 512a_100020586998_100000185263 [0,1,0,0,0,1|2,0,0]=4 5413 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)F 2708a_100000205154_100020586998 [0,1,0,0,0,1|2,0,0]=4 5414 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)F 273464a_100000205154_100020586998 [0,1,0,0,0,1|2,0,0]=4 5415 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)F 273464a_100020586998_100000205154 [0,1,0,0,0,1|2,0,0]=4 5416 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)F 512a_100000205154_100020586998 [0,1,0,0,0,1|2,0,0]=4 5417 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)F 512a_100020586998_100000205154 [0,1,0,0,0,1|2,0,0]=4 5418 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)O 2708a_100000747277_100020586998 [0,1,0,0,0,1|2,0,0]=4 5419 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)O 273464a_100000747277_100020586998 [0,1,0,0,0,1|2,0,0]=4 5420 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)O 273464a_100020586998_100000747277 [0,1,0,0,0,1|2,0,0]=4 5421 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)O 512a_100000747277_100020586998 [0,1,0,0,0,1|2,0,0]=4 5422 B16R1.119 C=CCNC(=O)NCCc1cccc(c1)O 512a_100020586998_100000747277 [0,1,0,0,0,1|2,0,0]=4 5423 B16R1.119 C=CCOC(=O)CNCc1cccc(=O)[nH]1 2230a_100000696482_100000033060 [0,1,0,0,0,1|2,0,0]=4 5424 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)Br 2230a_100000174977_100000033060 [0,1,0,0,0,1|1,0,0]=3 5425 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)Br 34a_100000174977_100000033060 [0,1,0,0,0,1|1,0,0]=3 5426 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)C 2230a_100000185548_100000033060 [0,1,0,0,0,1|1,0,0]=3 5427 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)C 34a_100000185548_100000033060 [0,1,0,0,0,1|1,0,0]=3 5428 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)Cl 2230a_100000174878_100000033060 [0,1,0,0,0,1|1,0,0]=3 5429 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)Cl 34a_100000174878_100000033060 [0,1,0,0,0,1|1,0,0]=3 5430 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)F 2230a_100000174948_100000033060 [0,1,0,0,0,1|1,0,0]=3 5431 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)F 34a_100000174948_100000033060 [0,1,0,0,0,1|1,0,0]=3 5432 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)I 2230a_100000106179_100000033060 [0,1,0,0,0,1|1,0,0]=3 5433 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)I 34a_100000106179_100000033060 [0,1,0,0,0,1|1,0,0]=3 5434 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000033060 [0,1,0,0,0,1|1,0,0]=3 5435 B16R1.119 C=CCOC(=O)CNCc1cccc(c1)O 34a_100000743036_100000033060 [0,1,0,0,0,1|1,0,0]=3 5436 B16R1.119 C=CCOC(=O)CNCc1cccc(n1)Br 2230a_100016987751_100000033060 [0,1,0,0,0,1|2,0,0]=4 5437 B16R1.119 C=CCOC(=O)CNCc1cccc(n1)C 34a_100000701342_100000033060 [0,1,0,0,0,1|2,0,0]=4 5438 B16R1.119 C=CCOC(=O)CNCc1cccc(n1)Cl 2230a_100016990191_100000033060 [0,1,0,0,0,1|2,0,0]=4 5439 B16R1.119 C=CCOC(=O)CNCc1cccc(n1)F 2230a_100015188798_100000033060 [0,1,0,0,0,1|2,0,0]=4 5440 B16R1.119 C=CCOC(=O)CNCc1cccc(n1)F 34a_100015188798_100000033060 [0,1,0,0,0,1|2,0,0]=4 5441 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)Br 2230a_100025757509_100000033060 [0,1,0,0,0,1|2,0,0]=4 5442 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)Br 34a_100025757509_100000033060 [0,1,0,0,0,1|2,0,0]=4 5443 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)C 34a_100011934566_100000033060 [0,1,0,0,0,1|2,0,0]=4 5444 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)Cl 2230a_100015205668_100000033060 [0,1,0,0,0,1|2,0,0]=4 5445 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)Cl 34a_100015205668_100000033060 [0,1,0,0,0,1|2,0,0]=4 5446 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)F 2230a_100015188774_100000033060 [0,1,0,0,0,1|2,0,0]=4 5447 B16R1.119 C=CCOC(=O)CNCc1ccnc(c1)F 34a_100015188774_100000033060 [0,1,0,0,0,1|2,0,0]=4 5448 B16R1.119 C=CCOC(=O)CNCc1cncc(c1)C 2230a_100000692839_100000033060 [0,1,0,0,0,1|2,0,0]=4 5449 B16R1.119 C=CCOC(=O)CNCc1cncc(c1)C 34a_100000692839_100000033060 [0,1,0,0,0,1|2,0,0]=4 5450 B16R1.119 C=CCOC(=O)CNCc1cncc(c1)Cl 2230a_200020614424_100000033060 [0,1,0,0,0,1|2,0,0]=4 5451 B16R1.119 C=CCOC(=O)CNCc1cncc(c1)F 2230a_100011962886_100000033060 [0,1,0,0,0,1|2,0,0]=4 5452 B16R1.119 C=CCOC(=O)CNCc1cncc(c1)F 34a_100011962886_100000033060 [0,1,0,0,0,1|2,0,0]=4 5453 B16R1.119 C=CCOC(=O)COCc1cc(ccn1)C 34a_100011998357_100000033060 [0,1,0,0,0,1|1,0,0]=3 5454 B16R1.119 C=CCOC(=O)COCc1cc(ccn1)Cl 34a_100000748867_100000033060 [0,1,0,0,0,1|1,0,0]=3 5455 B16R1.119 C=CCOC(=O)COCc1cc(ccn1)N 34a_100000692640_100000033060 [0,1,0,0,0,1|1,0,0]=3 5456 B16R1.119 C=CCOC(=O)COCc1cc(cnn1)C 34a_100016212594_100000033060 [0,1,0,0,0,1|2,0,0]=4 5457 B16R1.119 C=CCOC(=O)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000033060 [0,1,0,0,0,1|1,0,0]=3 5458 B16R1.119 C=CCOC(=O)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000033060 [0,1,0,0,0,1|1,0,0]=3 5459 B16R1.119 C=CCOC(=O)COCc1cccc(c1)Br 34a_100000687537_100000033060 [0,1,0,0,0,1|0,0,0]=2 5460 B16R1.119 C=CCOC(=O)COCc1cccc(c1)Br 7a_100000687537_100000033060 [0,1,0,0,0,1|0,0,0]=2 5461 B16R1.119 C=CCOC(=O)COCc1cccc(c1)C 34a_100011217746_100000033060 [0,1,0,0,0,1|0,0,0]=2 5462 B16R1.119 C=CCOC(=O)COCc1cccc(c1)C 7a_100011217746_100000033060 [0,1,0,0,0,1|0,0,0]=2 5463 B16R1.119 C=CCOC(=O)COCc1cccc(c1)Cl 34a_100000241301_100000033060 [0,1,0,0,0,1|0,0,0]=2 5464 B16R1.119 C=CCOC(=O)COCc1cccc(c1)Cl 7a_100000241301_100000033060 [0,1,0,0,0,1|0,0,0]=2 5465 B16R1.119 C=CCOC(=O)COCc1cccc(c1)F 34a_100000210976_100000033060 [0,1,0,0,0,1|0,0,0]=2 5466 B16R1.119 C=CCOC(=O)COCc1cccc(c1)F 7a_100000210976_100000033060 [0,1,0,0,0,1|0,0,0]=2 5467 B16R1.119 C=CCOC(=O)COCc1cccc(c1)I 34a_100011215336_100000033060 [0,1,0,0,0,1|0,0,0]=2 5468 B16R1.119 C=CCOC(=O)COCc1cccc(c1)I 7a_100011215336_100000033060 [0,1,0,0,0,1|0,0,0]=2 5469 B16R1.119 C=CCOC(=O)COCc1cccc(c1)N 34a_100000211919_100000033060 [0,1,0,0,0,1|0,0,0]=2 5470 B16R1.119 C=CCOC(=O)COCc1cccc(n1)Br 34a_100000694195_100000033060 [0,1,0,0,0,1|1,0,0]=3 5471 B16R1.119 C=CCOC(=O)COCc1cccc(n1)C 34a_100000690600_100000033060 [0,1,0,0,0,1|1,0,0]=3 5472 B16R1.119 C=CCOC(=O)COCc1cccc(n1)Cl 34a_100011998359_100000033060 [0,1,0,0,0,1|1,0,0]=3 5473 B16R1.119 C=CCOC(=O)COCc1cccc(n1)F 34a_100000086748_100000033060 [0,1,0,0,0,1|1,0,0]=3 5474 B16R1.119 C=CCOC(=O)COCc1ccnc(c1)Br 34a_100009814636_100000033060 [0,1,0,0,0,1|1,0,0]=3 5475 B16R1.119 C=CCOC(=O)COCc1ccnc(c1)Br 7a_100009814636_100000033060 [0,1,0,0,0,1|1,0,0]=3 5476 B16R1.119 C=CCOC(=O)COCc1ccnc(c1)C 34a_100011998630_100000033060 [0,1,0,0,0,1|1,0,0]=3 5477 B16R1.119 C=CCOC(=O)COCc1ccnc(c1)Cl 34a_100000748751_100000033060 [0,1,0,0,0,1|1,0,0]=3 5478 B16R1.119 C=CCOC(=O)COCc1ccnc(c1)F 34a_100000082451_100000033060 [0,1,0,0,0,1|1,0,0]=3 5479 B16R1.119 C=CCOC(=O)COCc1cncc(c1)Br 34a_100011259137_100000033060 [0,1,0,0,0,1|1,0,0]=3 5480 B16R1.119 C=CCOC(=O)COCc1cncc(c1)Br 7a_100011259137_100000033060 [0,1,0,0,0,1|1,0,0]=3 5481 B16R1.119 C=CCOC(=O)COCc1cncc(c1)C 34a_100011998709_100000033060 [0,1,0,0,0,1|1,0,0]=3 5482 B16R1.119 C=CCOC(=O)COCc1cncc(c1)C 7a_100011998709_100000033060 [0,1,0,0,0,1|1,0,0]=3 5483 B16R1.119 C=CCOC(=O)COCc1cncc(c1)Cl 34a_100000092867_100000033060 [0,1,0,0,0,1|1,0,0]=3 5484 B16R1.119 C=CCOC(=O)COCc1cncc(c1)Cl 7a_100000092867_100000033060 [0,1,0,0,0,1|1,0,0]=3 5485 B16R1.119 C=CCOC(=O)COCc1cncc(c1)F 34a_100011962875_100000033060 [0,1,0,0,0,1|1,0,0]=3 5486 B16R1.119 C=CCOC(=O)COCc1cncc(c1)F 7a_100011962875_100000033060 [0,1,0,0,0,1|1,0,0]=3 5487 B16R1.119 C=CCOC(=O)COCc1cncc(c1)N 34a_100000085308_100000033060 [0,1,0,0,0,1|1,0,0]=3 5488 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)Br 62a_100000033060_100010173614 [0,1,0,0,0,1|1,1,0]=4 5489 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)Br 62a_100010173614_100000033060 [0,1,0,0,0,1|1,1,0]=4 5490 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)C 62a_100000033060_100000718516 [0,1,0,0,0,1|1,1,0]=4 5491 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)C 62a_100000718516_100000033060 [0,1,0,0,0,1|1,1,0]=4 5492 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)Cl 62a_100000033060_100016988179 [0,1,0,0,0,1|1,1,0]=4 5493 B16R1.119 C=CCOC(=O)CSCc1cc(ccn1)Cl 62a_100016988179_100000033060 [0,1,0,0,0,1|1,1,0]=4 5494 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)Br 62a_100000033060_100000211773 [0,1,0,0,0,1|0,1,0]=3 5495 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)Br 62a_100000211773_100000033060 [0,1,0,0,0,1|0,1,0]=3 5496 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)C 62a_100000033060_100000211840 [0,1,0,0,0,1|0,1,0]=3 5497 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)C 62a_100000211840_100000033060 [0,1,0,0,0,1|0,1,0]=3 5498 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)Cl 62a_100000033060_100000187163 [0,1,0,0,0,1|0,1,0]=3 5499 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)Cl 62a_100000187163_100000033060 [0,1,0,0,0,1|0,1,0]=3 5500 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)F 62a_100000033060_100000230114 [0,1,0,0,0,1|0,1,0]=3 5501 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)F 62a_100000230114_100000033060 [0,1,0,0,0,1|0,1,0]=3 5502 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)I 62a_100000033060_100011218688 [0,1,0,0,0,1|0,1,0]=3 5503 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)I 62a_100011218688_100000033060 [0,1,0,0,0,1|0,1,0]=3 5504 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)O 62a_100000033060_100011660834 [0,1,0,0,0,1|0,1,0]=3 5505 B16R1.119 C=CCOC(=O)CSCc1cccc(c1)O 62a_100011660834_100000033060 [0,1,0,0,0,1|0,1,0]=3 5506 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)Br 62a_100000033060_100009889011 [0,1,0,0,0,1|1,1,0]=4 5507 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)Br 62a_100009889011_100000033060 [0,1,0,0,0,1|1,1,0]=4 5508 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)C 62a_100000033060_100000757606 [0,1,0,0,0,1|1,1,0]=4 5509 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)C 62a_100000757606_100000033060 [0,1,0,0,0,1|1,1,0]=4 5510 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)Cl 62a_100000033060_100000086093 [0,1,0,0,0,1|1,1,0]=4 5511 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)Cl 62a_100000086093_100000033060 [0,1,0,0,0,1|1,1,0]=4 5512 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)F 62a_100000033060_100009819644 [0,1,0,0,0,1|1,1,0]=4 5513 B16R1.119 C=CCOC(=O)CSCc1cccc(n1)F 62a_100009819644_100000033060 [0,1,0,0,0,1|1,1,0]=4 5514 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)Br 62a_100000033060_100010243470 [0,1,0,0,0,1|1,1,0]=4 5515 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)Br 62a_100010254460_100000033060 [0,1,0,0,0,1|1,1,0]=4 5516 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)C 62a_100000033060_200020672517 [0,1,0,0,0,1|1,1,0]=4 5517 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)C 62a_200020672517_100000033060 [0,1,0,0,0,1|1,1,0]=4 5518 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)Cl 62a_100000033060_100000764220 [0,1,0,0,0,1|1,1,0]=4 5519 B16R1.119 C=CCOC(=O)CSCc1ccnc(c1)Cl 62a_100000764220_100000033060 [0,1,0,0,0,1|1,1,0]=4 5520 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)Br 62a_100000033060_100000738771 [0,1,0,0,0,1|1,1,0]=4 5521 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)Br 62a_100000738771_100000033060 [0,1,0,0,0,1|1,1,0]=4 5522 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)C 62a_100000033060_100000716715 [0,1,0,0,0,1|1,1,0]=4 5523 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)C 62a_100000716715_100000033060 [0,1,0,0,0,1|1,1,0]=4 5524 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)Cl 62a_100000033060_100016992070 [0,1,0,0,0,1|1,1,0]=4 5525 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)Cl 62a_100016992070_100000033060 [0,1,0,0,0,1|1,1,0]=4 5526 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)F 62a_100000033060_100000725299 [0,1,0,0,0,1|1,1,0]=4 5527 B16R1.119 C=CCOC(=O)CSCc1cncc(c1)F 62a_100000725299_100000033060 [0,1,0,0,0,1|1,1,0]=4 5528 B16R1.119 CCCOC(=O)COCc1cccc(c1)Br 34a_100000687537_200011215008 [0,1,0,0,0,1|0,0,2]=4 5529 B16R1.119 CCCOC(=O)COCc1cccc(c1)Br 7a_100000687537_200011215008 [0,1,0,0,0,1|0,0,2]=4 5530 B16R1.119 CCCOC(=O)COCc1cccc(c1)C 34a_100011217746_200011215008 [0,1,0,0,0,1|0,0,2]=4 5531 B16R1.119 CCCOC(=O)COCc1cccc(c1)C 7a_100011217746_200011215008 [0,1,0,0,0,1|0,0,2]=4 5532 B16R1.119 CCCOC(=O)COCc1cccc(c1)Cl 34a_100000241301_200011215008 [0,1,0,0,0,1|0,0,2]=4 5533 B16R1.119 CCCOC(=O)COCc1cccc(c1)Cl 7a_100000241301_200011215008 [0,1,0,0,0,1|0,0,2]=4 5534 B16R1.119 CCCOC(=O)COCc1cccc(c1)F 34a_100000210976_200011215008 [0,1,0,0,0,1|0,0,2]=4 5535 B16R1.119 CCCOC(=O)COCc1cccc(c1)F 7a_100000210976_200011215008 [0,1,0,0,0,1|0,0,2]=4 5536 B16R1.119 CCCOC(=O)COCc1cccc(c1)I 34a_100011215336_200011215008 [0,1,0,0,0,1|0,0,2]=4 5537 B16R1.119 CCCOC(=O)COCc1cccc(c1)I 7a_100011215336_200011215008 [0,1,0,0,0,1|0,0,2]=4 5538 B16R1.119 CCCOC(=O)COCc1cccc(c1)N 34a_100000211919_200011215008 [0,1,0,0,0,1|0,0,2]=4 5539 B16R1.119 CCCOC(=O)OCOc1cccc(c1)Br 34a_100000210342_200000139673 [0,1,0,0,0,1|0,0,2]=4 5540 B16R1.119 CCCOC(=O)OCOc1cccc(c1)Br 7a_100000210342_200000139673 [0,1,0,0,0,1|0,0,2]=4 5541 B16R1.119 CCCOC(=O)OCOc1cccc(c1)C 34a_100000210337_200000139673 [0,1,0,0,0,1|0,0,2]=4 5542 B16R1.119 CCCOC(=O)OCOc1cccc(c1)C 7a_100000210337_200000139673 [0,1,0,0,0,1|0,0,2]=4 5543 B16R1.119 CCCOC(=O)OCOc1cccc(c1)Cl 34a_100000210295_200000139673 [0,1,0,0,0,1|0,0,2]=4 5544 B16R1.119 CCCOC(=O)OCOc1cccc(c1)Cl 7a_100000210295_200000139673 [0,1,0,0,0,1|0,0,2]=4 5545 B16R1.119 CCCOC(=O)OCOc1cccc(c1)F 34a_100000210426_200000139673 [0,1,0,0,0,1|0,0,2]=4 5546 B16R1.119 CCCOC(=O)OCOc1cccc(c1)F 7a_100000210426_200000139673 [0,1,0,0,0,1|0,0,2]=4 5547 B16R1.119 CCCOC(=O)OCOc1cccc(c1)I 34a_100000211634_200000139673 [0,1,0,0,0,1|0,0,2]=4 5548 B16R1.119 CCCOC(=O)OCOc1cccc(c1)I 7a_100000211634_200000139673 [0,1,0,0,0,1|0,0,2]=4 5549 B16R1.119 CCCOC(=O)OCOc1cccc(c1)N 34a_100000210217_200000139673 [0,1,0,0,0,1|0,0,2]=4 5550 B16R1.700 C=CC=CC(=O)COC(=O)c1ccccc1 1458a_100016291481_100000073877 [0,1,0,0,0,1|1,0,1]=4 5551 B16R1.700 C=CCCC(=O)CCC(=O)c1ccccc1 1458a_100000749702_100000750707 [0,1,0,0,0,1|2,0,0]=4 5552 B16R1.700 C=CCCC(=O)CC[C@@H](O)c1ccccc1 1458a_100000749702_100000729684 [0,1,0,0,0,1|2,0,0]=4 5553 B16R1.700 C=CCCC(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000754431 [0,1,0,0,0,1|2,0,0]=4 5554 B16R1.700 C=CCCC(=O)COC(=O)c1ccccc1 1458a_100000749702_100000073877 [0,1,0,0,0,1|1,0,0]=3 5555 B16R1.700 C=CCCC(=O)CSC(=S)c1ccccc1 1458a_100000043459_100000754431 [0,1,0,0,0,1|1,1,0]=4 5556 B16R1.700 C=CCCC(=O)NCC(C)c1ccccc1 11a_100000701038_100000749702 [0,1,0,0,0,1|2,0,0]=4 5557 B16R1.700 C=CCCC(=O)NCC(C)c1ccccc1 1626a_100000701038_100000749702 [0,1,0,0,0,1|2,0,0]=4 5558 B16R1.700 C=CCCC(=O)NCC(C)c1ccccc1 240690a_100000701038_100000749702 [0,1,0,0,0,1|2,0,0]=4 5559 B16R1.700 C=CCCC(=O)NCC(C)c1ccccc1 527a_100000701038_100000749702 [0,1,0,0,0,1|2,0,0]=4 5560 B16R1.700 C=CCCC(=O)NCC(O)c1ccccc1 240690a_100000210709_100000749702 [0,1,0,0,0,1|2,0,0]=4 5561 B16R1.700 C=CCCC(=O)NCC(O)c1ccccc1 527a_100000210709_100000749702 [0,1,0,0,0,1|2,0,0]=4 5562 B16R1.700 C=CCNC(=O)CCN(C)c1ccccc1 2230a_100000210012_100011222895 [0,1,0,0,0,1|2,0,0]=4 5563 B16R1.700 C=CCNC(=O)CCN(C)c1ccccc1 269982a_100000210012_100011222895 [0,1,0,0,0,1|2,0,0]=4 5564 B16R1.700 C=CCNC(=O)CNC(=O)c1ccccc1 1626a_100020586998_100000182045 [0,1,0,0,0,1|2,0,0]=4 5565 B16R1.700 C=CCNC(=O)CNC(=O)c1ccccc1 240690a_100020586998_100000182045 [0,1,0,0,0,1|2,0,0]=4 5566 B16R1.700 C=CCNC(=O)CNC(=O)c1ccccc1 527a_100020586998_100000182045 [0,1,0,0,0,1|2,0,0]=4 5567 B16R1.700 C=CCNC(=O)CN[C@H](C)c1ccccc1 2230a_100000751104_100000183597 [0,1,0,0,0,1|2,0,0]=4 5568 B16R1.700 C=CCNC(=O)CO[C@H](C)c1ccccc1 7a_100000761318_100000183597 [0,1,0,0,0,1|1,0,0]=3 5569 B16R1.700 C=CCNC(=O)CSC(=S)c1ccccc1 1626a_100020586998_100000043459 [0,1,0,0,0,1|1,1,0]=4 5570 B16R1.700 C=CCNC(=O)CSC(=S)c1ccccc1 240690a_100020586998_100000043459 [0,1,0,0,0,1|1,1,0]=4 5571 B16R1.700 C=CCNC(=O)CSC(=S)c1ccccc1 527a_100020586998_100000043459 [0,1,0,0,0,1|1,1,0]=4 5572 B16R1.700 C=CCNC(=O)CSC(C)c1ccccc1 62a_100000183597_100000230085 [0,1,0,0,0,1|1,1,0]=4 5573 B16R1.700 C=CCNC(=O)CSC(C)c1ccccc1 62a_100000230085_100000183597 [0,1,0,0,0,1|1,1,0]=4 5574 B16R1.700 C=CCNC(=O)NCC(C)c1ccccc1 2708a_100000701038_100020586998 [0,1,0,0,0,1|2,0,0]=4 5575 B16R1.700 C=CCNC(=O)NCC(C)c1ccccc1 273464a_100000701038_100020586998 [0,1,0,0,0,1|2,0,0]=4 5576 B16R1.700 C=CCNC(=O)NCC(C)c1ccccc1 273464a_100020586998_100000701038 [0,1,0,0,0,1|2,0,0]=4 5577 B16R1.700 C=CCNC(=O)NCC(C)c1ccccc1 512a_100020586998_100000701038 [0,1,0,0,0,1|2,0,0]=4 5578 B16R1.700 C=CCNC(=O)NCC(O)c1ccccc1 273464a_100000210709_100020586998 [0,1,0,0,0,1|2,0,0]=4 5579 B16R1.700 C=CCNC(=O)NCC(O)c1ccccc1 273464a_100020586998_100000210709 [0,1,0,0,0,1|2,0,0]=4 5580 B16R1.700 C=CCNC(=O)NCC(O)c1ccccc1 512a_100020586998_100000210709 [0,1,0,0,0,1|2,0,0]=4 5581 B16R1.700 C=CCOC(=O)CNC(C)c1ccccn1 2230a_100000181244_100000033060 [0,1,0,0,0,1|2,0,0]=4 5582 B16R1.700 C=CCOC(=O)CNC(C)c1cccnc1 2230a_100000195435_100000033060 [0,1,0,0,0,1|2,0,0]=4 5583 B16R1.700 C=CCOC(=O)CNC(C)c1ccncc1 2230a_100000181269_100000033060 [0,1,0,0,0,1|2,0,0]=4 5584 B16R1.700 C=CCOC(=O)CN[C@H](C)c1ccccc1 2230a_100000751104_100000033060 [0,1,0,0,0,1|1,0,0]=3 5585 B16R1.700 C=CCOC(=O)CO[C@H](C)c1ccccc1 34a_100000761318_100000033060 [0,1,0,0,0,1|0,0,0]=2 5586 B16R1.700 C=CCOC(=O)CO[C@H](C)c1ccccc1 7a_100000761318_100000033060 [0,1,0,0,0,1|0,0,0]=2 5587 B16R1.700 C=CCOC(=O)CSC(C)c1ccccc1 62a_100000033060_100000230085 [0,1,0,0,0,1|0,1,0]=3 5588 B16R1.700 C=CCOC(=O)CSC(C)c1ccccc1 62a_100000230085_100000033060 [0,1,0,0,0,1|0,1,0]=3 5589 B16R1.700 CCCOC(=O)CO[C@H](C)c1ccccc1 34a_100000761318_200011215008 [0,1,0,0,0,1|0,0,2]=4 5590 B16R1.700 CCCOC(=O)CO[C@H](C)c1ccccc1 7a_100000761318_200011215008 [0,1,0,0,0,1|0,0,2]=4 5591 B16R1.849 C=CC(C)CC(=O)C/C=C/c1ccccc1 1458a_100011934298_100016265936 [0,1,0,0,0,1|2,0,0]=4 5592 B16R1.849 C=CC(C)CC(=O)CC#Cc1ccccc1 1458a_100011934298_100011352542 [0,1,0,0,0,1|2,0,0]=4 5593 B16R1.849 C=CC(C)CC(=O)CCCc1ccccc1 1458a_100011934298_100000211621 [0,1,0,0,0,1|2,0,0]=4 5594 B16R1.849 C=CC(C)CC(=O)CCOc1ccccc1 1458a_100011934298_100000184471 [0,1,0,0,0,1|1,0,0]=3 5595 B16R1.849 C=CC(C)CC(=O)CCSc1ccccc1 1458a_100011934298_100000246102 [0,1,0,0,0,1|1,1,0]=4 5596 B16R1.849 C=CC(C)CC(=O)CSCc1ccccc1 1458a_100011934298_200011217039 [0,1,0,0,0,1|1,1,0]=4 5597 B16R1.849 C=CC(C)CC(=O)NCCc1ccccc1 11a_100000106460_100011934298 [0,1,0,0,0,1|2,0,0]=4 5598 B16R1.849 C=CC(C)CC(=O)NCCc1ccccc1 1626a_100000106460_100011934298 [0,1,0,0,0,1|2,0,0]=4 5599 B16R1.849 C=CC(C)CC(=O)NCCc1ccccc1 240690a_100000106460_100011934298 [0,1,0,0,0,1|2,0,0]=4 5600 B16R1.849 C=CC(C)CC(=O)NCCc1ccccc1 527a_100000106460_100011934298 [0,1,0,0,0,1|2,0,0]=4 5601 B16R1.1497 C=CC=CC(=O)CC(=O)Oc1ccccc1 1458a_100016291481_100009813826 [0,1,0,0,0,1|1,0,1]=4 5602 B16R1.1497 C=CCCC(=O)CC(=O)Cc1ccccc1 1458a_100000749702_100000233483 [0,1,0,0,0,1|2,0,0]=4 5603 B16R1.1497 C=CCCC(=O)CC(=O)Nc1ccccc1 1458a_100000749702_100000182850 [0,1,0,0,0,1|2,0,0]=4 5604 B16R1.1497 C=CCCC(=O)CC(=O)Oc1ccccc1 1458a_100000749702_100009813826 [0,1,0,0,0,1|1,0,0]=3 5605 B16R1.1497 C=CCCC(=O)CN(C)Cc1ccccc1 1458a_100000745601_100000754431 [0,1,0,0,0,1|2,0,0]=4 5606 B16R1.1497 C=CCNC(=O)CC(=O)Oc1ccccc1 240690a_100020586998_200000075362 [0,1,0,0,0,1|1,0,0]=3 5607 B16R1.1497 C=CCNC(=O)CN(C)Cc1ccccc1 2230a_100000186898_100000183597 [0,1,0,0,0,1|2,0,0]=4 5608 B16R1.1497 C=CCNC(=O)CN(C)Cc1ccccc1 240690a_100020586998_100000745601 [0,1,0,0,0,1|2,0,0]=4 5609 B16R1.1497 C=CCNC(=O)CN(C)Cc1ccccc1 269982a_100000186898_100000183597 [0,1,0,0,0,1|2,0,0]=4 5610 B16R1.1497 C=CCNC(=O)CN(C)Cc1ccccc1 527a_100020586998_100000745601 [0,1,0,0,0,1|2,0,0]=4 5611 B16R1.1497 C=CCOC(=O)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000033060 [0,1,0,0,0,1|2,0,0]=4 5612 B16R1.1497 C=CCOC(=O)CC(=O)Cc1ccccn1 1458a_100000233486_100000033060 [0,1,0,0,0,1|2,0,0]=4 5613 B16R1.1497 C=CCOC(=O)CC(=O)Cc1cccnc1 1458a_100000737805_100000033060 [0,1,0,0,0,1|2,0,0]=4 5614 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccccc1 2230a_100000186898_100000033060 [0,1,0,0,0,1|1,0,0]=3 5615 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccccc1 269982a_100000186898_100000033060 [0,1,0,0,0,1|1,0,0]=3 5616 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccccn1 2230a_100000207498_100000033060 [0,1,0,0,0,1|2,0,0]=4 5617 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccccn1 269982a_100000207498_100000033060 [0,1,0,0,0,1|2,0,0]=4 5618 B16R1.1497 C=CCOC(=O)CN(C)Cc1cccnc1 2230a_100000184577_100000033060 [0,1,0,0,0,1|2,0,0]=4 5619 B16R1.1497 C=CCOC(=O)CN(C)Cc1cccnc1 269982a_100000184577_100000033060 [0,1,0,0,0,1|2,0,0]=4 5620 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccncc1 2230a_100000187231_100000033060 [0,1,0,0,0,1|2,0,0]=4 5621 B16R1.1497 C=CCOC(=O)CN(C)Cc1ccncc1 269982a_100000187231_100000033060 [0,1,0,0,0,1|2,0,0]=4 5622 B16R1.1516 C=CCCC(=O)C(C)CCc1ccccc1 1458a_100011435293_100000754431 [0,1,0,0,0,1|2,0,0]=4 5623 B16R1.1516 C=CCCC(=O)C(C)SCc1ccccc1 1458a_100000149570_100000754431 [0,1,0,0,0,1|1,1,0]=4 5624 B16R1.1516 C=CCCC(=O)C(O)CCc1ccccc1 1458a_100000242596_100000754431 [0,1,0,0,0,1|2,0,0]=4 5625 B16R1.1516 C=CCCC(=O)N(C)CCc1ccccc1 11a_100000207497_100000749702 [0,1,0,0,0,1|2,0,0]=4 5626 B16R1.1516 C=CCCC(=O)N(C)CCc1ccccc1 1626a_100000207497_100000749702 [0,1,0,0,0,1|2,0,0]=4 5627 B16R1.1516 C=CCCC(=O)N(C)CCc1ccccc1 240690a_100000207497_100000749702 [0,1,0,0,0,1|2,0,0]=4 5628 B16R1.1516 C=CCCC(=O)N(C)CCc1ccccc1 527a_100000207497_100000749702 [0,1,0,0,0,1|2,0,0]=4 5629 B16R1.1516 C=CCCC(=O)[C@H](C)OCc1ccccc1 1458a_100000703211_100000754431 [0,1,0,0,0,1|1,0,0]=3 5630 B16R1.1516 C=CCNC(=O)C(C)CCc1ccccc1 1626a_100020586998_100011435293 [0,1,0,0,0,1|2,0,0]=4 5631 B16R1.1516 C=CCNC(=O)C(C)CCc1ccccc1 240690a_100020586998_100011435293 [0,1,0,0,0,1|2,0,0]=4 5632 B16R1.1516 C=CCNC(=O)C(C)CCc1ccccc1 527a_100020586998_100011435293 [0,1,0,0,0,1|2,0,0]=4 5633 B16R1.1516 C=CCNC(=O)C(C)NCc1ccccc1 2230a_100015324214_100000230288 [0,1,0,0,0,1|2,0,0]=4 5634 B16R1.1516 C=CCNC(=O)C(C)OCc1ccccc1 7a_100000210790_100000230288 [0,1,0,0,0,1|1,0,0]=3 5635 B16R1.1516 C=CCNC(=O)C(C)SCc1ccccc1 1626a_100020586998_100000149570 [0,1,0,0,0,1|1,1,0]=4 5636 B16R1.1516 C=CCNC(=O)C(C)SCc1ccccc1 240690a_100020586998_100000149570 [0,1,0,0,0,1|1,1,0]=4 5637 B16R1.1516 C=CCNC(=O)C(C)SCc1ccccc1 527a_100020586998_100000149570 [0,1,0,0,0,1|1,1,0]=4 5638 B16R1.1516 C=CCNC(=O)C(C)SCc1ccccc1 62a_100000211182_100000230288 [0,1,0,0,0,1|1,1,0]=4 5639 B16R1.1516 C=CCNC(=O)C(C)SCc1ccccc1 62a_100000230288_100015291786 [0,1,0,0,0,1|1,1,0]=4 5640 B16R1.1516 C=CCNC(=O)C(O)CCc1ccccc1 240690a_100020586998_100000242596 [0,1,0,0,0,1|2,0,0]=4 5641 B16R1.1516 C=CCNC(=O)N(C)CCc1ccccc1 273464a_100020586998_100000207497 [0,1,0,0,0,1|2,0,0]=4 5642 B16R1.1516 C=CCNC(=O)[C@H](C)OCc1ccccc1 1626a_100020586998_100000703211 [0,1,0,0,0,1|1,0,0]=3 5643 B16R1.1516 C=CCNC(=O)[C@H](C)OCc1ccccc1 240690a_100020586998_100000703211 [0,1,0,0,0,1|1,0,0]=3 5644 B16R1.1516 C=CCNC(=O)[C@H](C)OCc1ccccc1 527a_100020586998_100000703211 [0,1,0,0,0,1|1,0,0]=3 5645 B16R1.1516 CCCOC(=O)C(C)OCc1ccccc1 34a_100000037348_100015291786 [0,1,0,0,0,1|0,0,2]=4 5646 B16R1.1516 CCCOC(=O)C(C)OCc1ccccc1 34a_100000210790_100000760410 [0,1,0,0,0,1|0,0,2]=4 5647 B16R1.1516 CCCOC(=O)C(C)OCc1ccccc1 7a_100000037348_100000211182 [0,1,0,0,0,1|0,0,2]=4 5648 B16R1.1516 CCCOC(=O)C(C)OCc1ccccc1 7a_100000210790_100000760410 [0,1,0,0,0,1|0,0,2]=4 5649 B16R1.1694 C#CCOCC(=O)CCOc1ccccc1 1458a_100011251226_100000184471 [0,1,0,0,0,1|0,0,2]=4 5650 B16R1.1694 C/C=C/C=CC(=O)CCOc1ccccc1 1458a_100000185730_100000184471 [0,1,0,0,0,1|1,0,1]=4 5651 B16R1.1694 C/C=C/COC(C)COCc1ccccc1 34a_100000764311_100102629194 [0,1,0,0,0,1|1,0,1]=4 5652 B16R1.1694 C/C=C/COC(C)COCc1ccccc1 7a_100000764311_100102629194 [0,1,0,0,0,1|1,0,1]=4 5653 B16R1.1694 C=CCCCC(=O)C/C=C/c1ccccc1 1458a_100000766728_100016265936 [0,1,0,0,0,1|2,0,0]=4 5654 B16R1.1694 C=CCCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000757094 [0,1,0,0,0,1|2,0,0]=4 5655 B16R1.1694 C=CCCCC(=O)CC#Cc1ccccc1 1458a_100000766728_100011352542 [0,1,0,0,0,1|2,0,0]=4 5656 B16R1.1694 C=CCCCC(=O)CCCc1ccccc1 1458a_100000766728_100000211621 [0,1,0,0,0,1|2,0,0]=4 5657 B16R1.1694 C=CCCCC(=O)CCCc1ccccc1 1458a_100011207963_100000757094 [0,1,0,0,0,1|2,0,0]=4 5658 B16R1.1694 C=CCCCC(=O)CCOc1ccccc1 1458a_100000182761_100000757094 [0,1,0,0,0,1|1,0,0]=3 5659 B16R1.1694 C=CCCCC(=O)CCOc1ccccc1 1458a_100000766728_100000184471 [0,1,0,0,0,1|1,0,0]=3 5660 B16R1.1694 C=CCCCC(=O)CCSc1ccccc1 1458a_100000182436_100000757094 [0,1,0,0,0,1|1,1,0]=4 5661 B16R1.1694 C=CCCCC(=O)CCSc1ccccc1 1458a_100000766728_100000246102 [0,1,0,0,0,1|1,1,0]=4 5662 B16R1.1694 C=CCCCC(=O)COCc1ccccc1 1458a_100000230186_100000757094 [0,1,0,0,0,1|1,0,0]=3 5663 B16R1.1694 C=CCCCC(=O)CSCc1ccccc1 1458a_100000150264_100000757094 [0,1,0,0,0,1|1,1,0]=4 5664 B16R1.1694 C=CCCCC(=O)CSCc1ccccc1 1458a_100000766728_200011217039 [0,1,0,0,0,1|1,1,0]=4 5665 B16R1.1694 C=CCCCC(=O)NCCc1ccccc1 11a_100000106460_100000766728 [0,1,0,0,0,1|2,0,0]=4 5666 B16R1.1694 C=CCCCC(=O)NCCc1ccccc1 1626a_100000106460_100000766728 [0,1,0,0,0,1|2,0,0]=4 5667 B16R1.1694 C=CCCCC(=O)NCCc1ccccc1 240690a_100000106460_100000766728 [0,1,0,0,0,1|2,0,0]=4 5668 B16R1.1694 C=CCCCC(=O)NCCc1ccccc1 527a_100000106460_100000766728 [0,1,0,0,0,1|2,0,0]=4 5669 B16R1.1694 C=CCCNC(=O)C/C=C/c1ccccc1 11a_100015191253_100011219626 [0,1,0,0,0,1|2,0,0]=4 5670 B16R1.1694 C=CCCNC(=O)C/C=C/c1ccccc1 1626a_100015191253_100011219626 [0,1,0,0,0,1|2,0,0]=4 5671 B16R1.1694 C=CCCNC(=O)C/C=C/c1ccccc1 240690a_100015191253_100011219626 [0,1,0,0,0,1|2,0,0]=4 5672 B16R1.1694 C=CCCNC(=O)CCCc1ccccc1 11a_100015191253_100011207963 [0,1,0,0,0,1|2,0,0]=4 5673 B16R1.1694 C=CCCNC(=O)CCCc1ccccc1 1626a_100015191253_100011207963 [0,1,0,0,0,1|2,0,0]=4 5674 B16R1.1694 C=CCCNC(=O)CCCc1ccccc1 240690a_100015191253_100011207963 [0,1,0,0,0,1|2,0,0]=4 5675 B16R1.1694 C=CCCNC(=O)CCCc1ccccc1 527a_100015191253_100011207963 [0,1,0,0,0,1|2,0,0]=4 5676 B16R1.1694 C=CCCNC(=O)CCOc1ccccc1 11a_100015191253_100000182761 [0,1,0,0,0,1|1,0,0]=3 5677 B16R1.1694 C=CCCNC(=O)CCOc1ccccc1 1626a_100015191253_100000182761 [0,1,0,0,0,1|1,0,0]=3 5678 B16R1.1694 C=CCCNC(=O)CCOc1ccccc1 240690a_100015191253_100000182761 [0,1,0,0,0,1|1,0,0]=3 5679 B16R1.1694 C=CCCNC(=O)CCSc1ccccc1 11a_100015191253_100000182436 [0,1,0,0,0,1|1,1,0]=4 5680 B16R1.1694 C=CCCNC(=O)CCSc1ccccc1 1626a_100015191253_100000182436 [0,1,0,0,0,1|1,1,0]=4 5681 B16R1.1694 C=CCCNC(=O)CCSc1ccccc1 240690a_100015191253_100000182436 [0,1,0,0,0,1|1,1,0]=4 5682 B16R1.1694 C=CCCNC(=O)COCc1ccccc1 11a_100015191253_100000230186 [0,1,0,0,0,1|1,0,0]=3 5683 B16R1.1694 C=CCCNC(=O)COCc1ccccc1 1626a_100015191253_100000230186 [0,1,0,0,0,1|1,0,0]=3 5684 B16R1.1694 C=CCCNC(=O)COCc1ccccc1 240690a_100015191253_100000230186 [0,1,0,0,0,1|1,0,0]=3 5685 B16R1.1694 C=CCCNC(=O)COCc1ccccc1 527a_100015191253_100000230186 [0,1,0,0,0,1|1,0,0]=3 5686 B16R1.1694 C=CCCNC(=O)CSCc1ccccc1 11a_100015191253_100000150264 [0,1,0,0,0,1|1,1,0]=4 5687 B16R1.1694 C=CCCNC(=O)CSCc1ccccc1 1626a_100015191253_100000150264 [0,1,0,0,0,1|1,1,0]=4 5688 B16R1.1694 C=CCCNC(=O)CSCc1ccccc1 240690a_100015191253_100000150264 [0,1,0,0,0,1|1,1,0]=4 5689 B16R1.1694 C=CCCNC(=O)CSCc1ccccc1 527a_100015191253_100000150264 [0,1,0,0,0,1|1,1,0]=4 5690 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 2708a_100000106460_100015191253 [0,1,0,0,0,1|2,0,0]=4 5691 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 2708a_100015191253_100000106460 [0,1,0,0,0,1|2,0,0]=4 5692 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 273464a_100000106460_100015191253 [0,1,0,0,0,1|2,0,0]=4 5693 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 273464a_100015191253_100000106460 [0,1,0,0,0,1|2,0,0]=4 5694 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 512a_100000106460_100015191253 [0,1,0,0,0,1|2,0,0]=4 5695 B16R1.1694 C=CCCNC(=O)NCCc1ccccc1 512a_100015191253_100000106460 [0,1,0,0,0,1|2,0,0]=4 5696 B16R1.1694 C=CCCOC(C)COCc1ccccc1 34a_100000764311_100000754431 [0,1,0,0,0,1|1,0,1]=4 5697 B16R1.1694 C=CCCOC(C)COCc1ccccc1 7a_100000764311_100000754431 [0,1,0,0,0,1|1,0,1]=4 5698 B16R1.1694 C=CCNCC(=O)NCCc1ccccc1 2230a_100000747479_100000210623 [0,1,0,0,0,1|2,0,0]=4 5699 B16R1.1694 C=CCNCC(=O)NCCc1ccccc1 2230a_100020586998_100000183012 [0,1,0,0,0,1|2,0,0]=4 5700 B16R1.1694 C=CCNCC(=O)NCCc1ccccc1 34a_100000747479_100015514636 [0,1,0,0,0,1|2,0,0]=4 5701 B16R1.1694 C=CCNCC(=O)NOCc1ccccc1 2230a_100020586998_100000230105 [0,1,0,0,0,1|2,0,0]=4 5702 B16R1.1694 C=CCNCC(=O)OCCc1ccccc1 2230a_100020586998_200000077782 [0,1,0,0,0,1|2,0,0]=4 5703 B16R1.1694 C=CCNNC(=O)C/C=C/c1ccccc1 22a_100020588587_100011219626 [0,1,0,0,0,1|2,0,0]=4 5704 B16R1.1694 C=CCNNC(=O)CCCc1ccccc1 22a_100020588587_100011207963 [0,1,0,0,0,1|2,0,0]=4 5705 B16R1.1694 C=CCNNC(=O)CCOc1ccccc1 22a_100020588587_100000182761 [0,1,0,0,0,1|1,0,0]=3 5706 B16R1.1694 C=CCNNC(=O)CCSc1ccccc1 22a_100020588587_100000182436 [0,1,0,0,0,1|1,1,0]=4 5707 B16R1.1694 C=CCNNC(=O)COCc1ccccc1 22a_100020588587_100000230186 [0,1,0,0,0,1|1,0,0]=3 5708 B16R1.1694 C=CCNNC(=O)CSCc1ccccc1 22a_100020588587_100000150264 [0,1,0,0,0,1|1,1,0]=4 5709 B16R1.1694 C=CCNNC(=O)NCCc1ccccc1 273464a_100000106460_100020588587 [0,1,0,0,0,1|2,0,0]=4 5710 B16R1.1694 C=CCNNC(=O)NCCc1ccccc1 512a_100000106460_100020588587 [0,1,0,0,0,1|2,0,0]=4 5711 B16R1.1694 C=CCNNC(=O)NCCc1ccccc1 512a_100020588587_100000106460 [0,1,0,0,0,1|2,0,0]=4 5712 B16R1.1694 C=CCOCC(=O)NCCc1ccccc1 34a_200000210373_100000183012 [0,1,0,0,0,1|1,0,0]=3 5713 B16R1.1694 C=CCOCC(=O)NOCc1ccccc1 34a_200000210373_100000230105 [0,1,0,0,0,1|1,0,0]=3 5714 B16R1.1694 C=CCOCC(=O)OCCc1ccccc1 34a_200000210373_200000077782 [0,1,0,0,0,1|1,0,0]=3 5715 B16R1.1694 C=CCOCC(C)COCc1ccccc1 34a_200000210373_100011216253 [0,1,0,0,0,1|1,0,1]=4 5716 B16R1.1694 C=CCOCC(C)COCc1ccccc1 34a_200011216033_100015514636 [0,1,0,0,0,1|1,0,1]=4 5717 B16R1.1694 C=CCOCC(C)COCc1ccccc1 7a_200011216033_100015514636 [0,1,0,0,0,1|1,0,1]=4 5718 B16R1.1694 C=CCOC[C@@H](N)COCc1ccccc1 34a_100016995297_100015514636 [0,1,0,0,0,1|1,0,1]=4 5719 B16R1.1694 C=CCSCC(=O)C/C=C/c1ccccc1 1458a_100000230395_100016265936 [0,1,0,0,0,1|1,1,0]=4 5720 B16R1.1694 C=CCSCC(=O)CC#Cc1ccccc1 1458a_100000230395_100011352542 [0,1,0,0,0,1|1,1,0]=4 5721 B16R1.1694 C=CCSCC(=O)CCCc1ccccc1 1458a_100000230395_100000211621 [0,1,0,0,0,1|1,1,0]=4 5722 B16R1.1694 C=CCSCC(=O)CCOc1ccccc1 1458a_100000230395_100000184471 [0,1,0,0,0,1|0,1,0]=3 5723 B16R1.1694 C=CCSCC(=O)CCSc1ccccc1 1458a_100000230395_100000246102 [0,1,0,0,0,1|0,2,0]=4 5724 B16R1.1694 C=CCSCC(=O)CSCc1ccccc1 1458a_100000230395_200011217039 [0,1,0,0,0,1|0,2,0]=4 5725 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 11a_100000106460_100000230395 [0,1,0,0,0,1|1,1,0]=4 5726 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 1626a_100000106460_100000230395 [0,1,0,0,0,1|1,1,0]=4 5727 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 240690a_100000106460_100000230395 [0,1,0,0,0,1|1,1,0]=4 5728 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 527a_100000106460_100000230395 [0,1,0,0,0,1|1,1,0]=4 5729 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 62a_100000183012_100000210623 [0,1,0,0,0,1|1,1,0]=4 5730 B16R1.1694 C=CCSCC(=O)NCCc1ccccc1 62a_100000210623_100000183012 [0,1,0,0,0,1|1,1,0]=4 5731 B16R1.1694 C=CCSCC(=O)NOCc1ccccc1 62a_100000210623_100000230105 [0,1,0,0,0,1|1,1,0]=4 5732 B16R1.1694 C=CCSCC(=O)NOCc1ccccc1 62a_100000230105_100000210623 [0,1,0,0,0,1|1,1,0]=4 5733 B16R1.1694 C=CCSCC(=O)OCCc1ccccc1 62a_100000210623_200000077782 [0,1,0,0,0,1|1,1,0]=4 5734 B16R1.1694 C=CCSCC(=O)OCCc1ccccc1 62a_200000077782_100000210623 [0,1,0,0,0,1|1,1,0]=4 5735 B16R1.1694 C=COCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000039644 [0,1,0,0,0,1|2,0,0]=4 5736 B16R1.1694 C=COCCC(=O)CCCc1ccccc1 1458a_100011207963_100000039644 [0,1,0,0,0,1|2,0,0]=4 5737 B16R1.1694 C=COCCC(=O)CCOc1ccccc1 1458a_100000182761_100000039644 [0,1,0,0,0,1|1,0,0]=3 5738 B16R1.1694 C=COCCC(=O)CCSc1ccccc1 1458a_100000182436_100000039644 [0,1,0,0,0,1|1,1,0]=4 5739 B16R1.1694 C=COCCC(=O)COCc1ccccc1 1458a_100000230186_100000039644 [0,1,0,0,0,1|1,0,0]=3 5740 B16R1.1694 C=COCCC(=O)CSCc1ccccc1 1458a_100000150264_100000039644 [0,1,0,0,0,1|1,1,0]=4 5741 B16R1.1694 CC=CCOC(C)COCc1ccccc1 34a_100000764311_100000070051 [0,1,0,0,0,1|1,0,1]=4 5742 B16R1.1694 CC=CCOC(C)COCc1ccccc1 7a_100000764311_100000070051 [0,1,0,0,0,1|1,0,1]=4 5743 B16R1.1694 CCCCOC(=O)COCc1ccccc1 34a_100000210790_100000211628 [0,1,0,0,0,1|0,0,2]=4 5744 B16R1.1694 CCCCOC(=O)COCc1ccccc1 7a_100000210790_100000211628 [0,1,0,0,0,1|0,0,2]=4 5745 B16R1.1694 CCCOCC(=O)CCOc1ccccc1 1458a_100000745993_100000184471 [0,1,0,0,0,1|0,0,2]=4 5746 B16R1.1694 COCCOC(=O)COCc1ccccc1 34a_100000210790_200000040189 [0,1,0,0,0,1|0,0,2]=4 5747 B16R1.1694 COCCOC(=O)COCc1ccccc1 7a_100000210790_200000040189 [0,1,0,0,0,1|0,0,2]=4 5748 B16R1.1694 O=C(CCOc1ccccc1)COCCO 1458a_100000708028_100000184471 [0,1,0,0,0,1|1,0,1]=4 5749 B16R1.4473 C=CC=CC(=O)CCOc1ccccc1Br 1458a_100016291481_100000695877 [0,1,0,0,0,1|1,0,1]=4 5750 B16R1.4473 C=CC=CC(=O)CCOc1ccccc1C 1458a_100016291481_100000184434 [0,1,0,0,0,1|1,0,1]=4 5751 B16R1.4473 C=CC=CC(=O)CCOc1ccccc1F 1458a_100016291481_100000183290 [0,1,0,0,0,1|1,0,1]=4 5752 B16R1.4473 C=CCCC(=O)CC#Cc1ccccc1Br 1458a_100000749702_100010706765 [0,1,0,0,0,1|2,0,0]=4 5753 B16R1.4473 C=CCCC(=O)CC#Cc1ccccc1F 1458a_100000749702_100010404167 [0,1,0,0,0,1|2,0,0]=4 5754 B16R1.4473 C=CCCC(=O)CCCc1ccccc1Br 1458a_100000749702_200011713681 [0,1,0,0,0,1|2,0,0]=4 5755 B16R1.4473 C=CCCC(=O)CCCc1ccccc1Cl 1458a_100000700343_100000754431 [0,1,0,0,0,1|2,0,0]=4 5756 B16R1.4473 C=CCCC(=O)CCCc1ccccc1O 1458a_100009859317_100000754431 [0,1,0,0,0,1|2,0,0]=4 5757 B16R1.4473 C=CCCC(=O)CCOc1ccccc1Br 1458a_100000740817_100000754431 [0,1,0,0,0,1|1,0,0]=3 5758 B16R1.4473 C=CCCC(=O)CCOc1ccccc1Br 1458a_100000749702_100000695877 [0,1,0,0,0,1|1,0,0]=3 5759 B16R1.4473 C=CCCC(=O)CCOc1ccccc1C 1458a_100000182324_100000754431 [0,1,0,0,0,1|1,0,0]=3 5760 B16R1.4473 C=CCCC(=O)CCOc1ccccc1C 1458a_100000749702_100000184434 [0,1,0,0,0,1|1,0,0]=3 5761 B16R1.4473 C=CCCC(=O)CCOc1ccccc1Cl 1458a_100000240438_100000754431 [0,1,0,0,0,1|1,0,0]=3 5762 B16R1.4473 C=CCCC(=O)CCOc1ccccc1F 1458a_100000184057_100000754431 [0,1,0,0,0,1|1,0,0]=3 5763 B16R1.4473 C=CCCC(=O)CCOc1ccccc1F 1458a_100000749702_100000183290 [0,1,0,0,0,1|1,0,0]=3 5764 B16R1.4473 C=CCCC(=O)CCSc1ccccc1F 1458a_100000208832_100000754431 [0,1,0,0,0,1|1,1,0]=4 5765 B16R1.4473 C=CCCC(=O)CSCc1ccccc1C 1458a_100000150258_100000754431 [0,1,0,0,0,1|1,1,0]=4 5766 B16R1.4473 C=CCCC(=O)CSCc1ccccc1Cl 1458a_100000150270_100000754431 [0,1,0,0,0,1|1,1,0]=4 5767 B16R1.4473 C=CCCC(=O)CSCc1ccccc1F 1458a_100000150260_100000754431 [0,1,0,0,0,1|1,1,0]=4 5768 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Br 11a_100000747383_100000749702 [0,1,0,0,0,1|2,0,0]=4 5769 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Br 1626a_100000747383_100000749702 [0,1,0,0,0,1|2,0,0]=4 5770 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Br 240690a_100000747383_100000749702 [0,1,0,0,0,1|2,0,0]=4 5771 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Br 527a_100000747383_100000749702 [0,1,0,0,0,1|2,0,0]=4 5772 B16R1.4473 C=CCCC(=O)NCCc1ccccc1C 11a_100000685071_100000749702 [0,1,0,0,0,1|2,0,0]=4 5773 B16R1.4473 C=CCCC(=O)NCCc1ccccc1C 1626a_100000685071_100000749702 [0,1,0,0,0,1|2,0,0]=4 5774 B16R1.4473 C=CCCC(=O)NCCc1ccccc1C 240690a_100000685071_100000749702 [0,1,0,0,0,1|2,0,0]=4 5775 B16R1.4473 C=CCCC(=O)NCCc1ccccc1C 527a_100000685071_100000749702 [0,1,0,0,0,1|2,0,0]=4 5776 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Cl 11a_100011207228_100000749702 [0,1,0,0,0,1|2,0,0]=4 5777 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Cl 1626a_100011207228_100000749702 [0,1,0,0,0,1|2,0,0]=4 5778 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Cl 240690a_100011207228_100000749702 [0,1,0,0,0,1|2,0,0]=4 5779 B16R1.4473 C=CCCC(=O)NCCc1ccccc1Cl 527a_100011207228_100000749702 [0,1,0,0,0,1|2,0,0]=4 5780 B16R1.4473 C=CCCC(=O)NCCc1ccccc1F 11a_100000185272_100000749702 [0,1,0,0,0,1|2,0,0]=4 5781 B16R1.4473 C=CCCC(=O)NCCc1ccccc1F 1626a_100000185272_100000749702 [0,1,0,0,0,1|2,0,0]=4 5782 B16R1.4473 C=CCCC(=O)NCCc1ccccc1F 240690a_100000185272_100000749702 [0,1,0,0,0,1|2,0,0]=4 5783 B16R1.4473 C=CCCC(=O)NCCc1ccccc1F 527a_100000185272_100000749702 [0,1,0,0,0,1|2,0,0]=4 5784 B16R1.4473 C=CCCC(=O)NCCc1ccccc1O 240690a_100011207237_100000749702 [0,1,0,0,0,1|2,0,0]=4 5785 B16R1.4473 C=CCCC(=O)NCCc1ccccc1O 527a_100011207237_100000749702 [0,1,0,0,0,1|2,0,0]=4 5786 B16R1.4473 C=CCNC(=O)CCCc1ccccc1Cl 1626a_100020586998_100000700343 [0,1,0,0,0,1|2,0,0]=4 5787 B16R1.4473 C=CCNC(=O)CCCc1ccccc1Cl 240690a_100020586998_100000700343 [0,1,0,0,0,1|2,0,0]=4 5788 B16R1.4473 C=CCNC(=O)CCCc1ccccc1Cl 527a_100020586998_100000700343 [0,1,0,0,0,1|2,0,0]=4 5789 B16R1.4473 C=CCNC(=O)CCCc1ccccc1O 240690a_100020586998_100009859317 [0,1,0,0,0,1|2,0,0]=4 5790 B16R1.4473 C=CCNC(=O)CCCc1ccccc1O 527a_100020586998_100009859317 [0,1,0,0,0,1|2,0,0]=4 5791 B16R1.4473 C=CCNC(=O)CCOc1cccc[n+]1[O-] 7a_100000211761_100011222895 [0,1,0,0,0,1|2,0,0]=4 5792 B16R1.4473 C=CCNC(=O)CCOc1ccccc1Br 240690a_100020586998_100000740817 [0,1,0,0,0,1|1,0,0]=3 5793 B16R1.4473 C=CCNC(=O)CCOc1ccccc1Br 7a_100000181306_100011222895 [0,1,0,0,0,1|1,0,0]=3 5794 B16R1.4473 C=CCNC(=O)CCOc1ccccc1C 1626a_100020586998_100000182324 [0,1,0,0,0,1|1,0,0]=3 5795 B16R1.4473 C=CCNC(=O)CCOc1ccccc1C 240690a_100020586998_100000182324 [0,1,0,0,0,1|1,0,0]=3 5796 B16R1.4473 C=CCNC(=O)CCOc1ccccc1C 7a_100000210338_100011222895 [0,1,0,0,0,1|1,0,0]=3 5797 B16R1.4473 C=CCNC(=O)CCOc1ccccc1Cl 1626a_100020586998_100000240438 [0,1,0,0,0,1|1,0,0]=3 5798 B16R1.4473 C=CCNC(=O)CCOc1ccccc1Cl 240690a_100020586998_100000240438 [0,1,0,0,0,1|1,0,0]=3 5799 B16R1.4473 C=CCNC(=O)CCOc1ccccc1Cl 7a_100000210172_100011222895 [0,1,0,0,0,1|1,0,0]=3 5800 B16R1.4473 C=CCNC(=O)CCOc1ccccc1F 1626a_100020586998_100000184057 [0,1,0,0,0,1|1,0,0]=3 5801 B16R1.4473 C=CCNC(=O)CCOc1ccccc1F 240690a_100020586998_100000184057 [0,1,0,0,0,1|1,0,0]=3 5802 B16R1.4473 C=CCNC(=O)CCOc1ccccc1F 7a_100000210171_100011222895 [0,1,0,0,0,1|1,0,0]=3 5803 B16R1.4473 C=CCNC(=O)CCOc1ccccc1I 7a_100000739446_100011222895 [0,1,0,0,0,1|1,0,0]=3 5804 B16R1.4473 C=CCNC(=O)CCOc1ccccc1N 7a_100000185747_100011222895 [0,1,0,0,0,1|1,0,0]=3 5805 B16R1.4473 C=CCNC(=O)CCOc1cccnc1Br 7a_100000744436_100011222895 [0,1,0,0,0,1|2,0,0]=4 5806 B16R1.4473 C=CCNC(=O)CCOc1cccnc1C 7a_100000745507_100011222895 [0,1,0,0,0,1|2,0,0]=4 5807 B16R1.4473 C=CCNC(=O)CCOc1cccnc1Cl 7a_100000757616_100011222895 [0,1,0,0,0,1|2,0,0]=4 5808 B16R1.4473 C=CCNC(=O)CCOc1cccnc1F 7a_100000061740_100011222895 [0,1,0,0,0,1|2,0,0]=4 5809 B16R1.4473 C=CCNC(=O)CCOc1cccnc1I 7a_100000034122_100011222895 [0,1,0,0,0,1|2,0,0]=4 5810 B16R1.4473 C=CCNC(=O)CCOc1cccnc1N 7a_100000211975_100011222895 [0,1,0,0,0,1|2,0,0]=4 5811 B16R1.4473 C=CCNC(=O)CCOc1cccoc1=O 7a_100000077404_100011222895 [0,1,0,0,0,1|2,0,0]=4 5812 B16R1.4473 C=CCNC(=O)CCOc1cnccc1C 7a_100011997053_100011222895 [0,1,0,0,0,1|2,0,0]=4 5813 B16R1.4473 C=CCNC(=O)CCSc1ccccc1Br 62a_100000695589_100011222895 [0,1,0,0,0,1|1,1,0]=4 5814 B16R1.4473 C=CCNC(=O)CCSc1ccccc1Br 62a_100011222895_100000695589 [0,1,0,0,0,1|1,1,0]=4 5815 B16R1.4473 C=CCNC(=O)CCSc1ccccc1C 62a_100000210755_100011222895 [0,1,0,0,0,1|1,1,0]=4 5816 B16R1.4473 C=CCNC(=O)CCSc1ccccc1C 62a_100011222895_100000210755 [0,1,0,0,0,1|1,1,0]=4 5817 B16R1.4473 C=CCNC(=O)CCSc1ccccc1Cl 62a_100000764095_100011222895 [0,1,0,0,0,1|1,1,0]=4 5818 B16R1.4473 C=CCNC(=O)CCSc1ccccc1Cl 62a_100011222895_100000764095 [0,1,0,0,0,1|1,1,0]=4 5819 B16R1.4473 C=CCNC(=O)CCSc1ccccc1F 1626a_100020586998_100000208832 [0,1,0,0,0,1|1,1,0]=4 5820 B16R1.4473 C=CCNC(=O)CCSc1ccccc1F 240690a_100020586998_100000208832 [0,1,0,0,0,1|1,1,0]=4 5821 B16R1.4473 C=CCNC(=O)CCSc1ccccc1F 527a_100020586998_100000208832 [0,1,0,0,0,1|1,1,0]=4 5822 B16R1.4473 C=CCNC(=O)CCSc1ccccc1F 62a_100011215700_100011222895 [0,1,0,0,0,1|1,1,0]=4 5823 B16R1.4473 C=CCNC(=O)CCSc1ccccc1F 62a_100011222895_100011215700 [0,1,0,0,0,1|1,1,0]=4 5824 B16R1.4473 C=CCNC(=O)CCSc1ccccc1N 62a_100000210017_100011222895 [0,1,0,0,0,1|1,1,0]=4 5825 B16R1.4473 C=CCNC(=O)CCSc1ccccc1N 62a_100011222895_100000210017 [0,1,0,0,0,1|1,1,0]=4 5826 B16R1.4473 C=CCNC(=O)CCSc1ccccc1O 62a_100000739446_100011222895 [0,1,0,0,0,1|1,1,0]=4 5827 B16R1.4473 C=CCNC(=O)CCSc1ccccc1O 62a_100011222895_100000739446 [0,1,0,0,0,1|1,1,0]=4 5828 B16R1.4473 C=CCNC(=O)CNCc1ccccc1Br 2230a_100000689332_100000183597 [0,1,0,0,0,1|2,0,0]=4 5829 B16R1.4473 C=CCNC(=O)CNCc1ccccc1Cl 2230a_100000174879_100000183597 [0,1,0,0,0,1|2,0,0]=4 5830 B16R1.4473 C=CCNC(=O)COCc1ccccc1Br 7a_100000756307_100000183597 [0,1,0,0,0,1|1,0,0]=3 5831 B16R1.4473 C=CCNC(=O)COCc1ccccc1C 7a_100000698903_100000183597 [0,1,0,0,0,1|1,0,0]=3 5832 B16R1.4473 C=CCNC(=O)COCc1ccccc1Cl 7a_100000210847_100000183597 [0,1,0,0,0,1|1,0,0]=3 5833 B16R1.4473 C=CCNC(=O)COCc1ccccc1F 7a_100000211962_100000183597 [0,1,0,0,0,1|1,0,0]=3 5834 B16R1.4473 C=CCNC(=O)COCc1ccccc1I 7a_100000187465_100000183597 [0,1,0,0,0,1|1,0,0]=3 5835 B16R1.4473 C=CCNC(=O)COCc1cccnc1Br 7a_100000719692_100000183597 [0,1,0,0,0,1|2,0,0]=4 5836 B16R1.4473 C=CCNC(=O)COCc1cccnc1C 7a_100000729262_100000183597 [0,1,0,0,0,1|2,0,0]=4 5837 B16R1.4473 C=CCNC(=O)COCc1cccnc1Cl 7a_100000748726_100000183597 [0,1,0,0,0,1|2,0,0]=4 5838 B16R1.4473 C=CCNC(=O)COCc1cccnc1F 7a_100000079888_100000183597 [0,1,0,0,0,1|2,0,0]=4 5839 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Br 62a_100000183597_100000184730 [0,1,0,0,0,1|1,1,0]=4 5840 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Br 62a_100000184730_100000183597 [0,1,0,0,0,1|1,1,0]=4 5841 B16R1.4473 C=CCNC(=O)CSCc1ccccc1C 1626a_100020586998_100000150258 [0,1,0,0,0,1|1,1,0]=4 5842 B16R1.4473 C=CCNC(=O)CSCc1ccccc1C 240690a_100020586998_100000150258 [0,1,0,0,0,1|1,1,0]=4 5843 B16R1.4473 C=CCNC(=O)CSCc1ccccc1C 527a_100020586998_100000150258 [0,1,0,0,0,1|1,1,0]=4 5844 B16R1.4473 C=CCNC(=O)CSCc1ccccc1C 62a_100000183597_100000211839 [0,1,0,0,0,1|1,1,0]=4 5845 B16R1.4473 C=CCNC(=O)CSCc1ccccc1C 62a_100000211839_100000183597 [0,1,0,0,0,1|1,1,0]=4 5846 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Cl 1626a_100020586998_100000150270 [0,1,0,0,0,1|1,1,0]=4 5847 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Cl 240690a_100020586998_100000150270 [0,1,0,0,0,1|1,1,0]=4 5848 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Cl 527a_100020586998_100000150270 [0,1,0,0,0,1|1,1,0]=4 5849 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Cl 62a_100000183597_100000187162 [0,1,0,0,0,1|1,1,0]=4 5850 B16R1.4473 C=CCNC(=O)CSCc1ccccc1Cl 62a_100000187162_100000183597 [0,1,0,0,0,1|1,1,0]=4 5851 B16R1.4473 C=CCNC(=O)CSCc1ccccc1F 1626a_100020586998_100000150260 [0,1,0,0,0,1|1,1,0]=4 5852 B16R1.4473 C=CCNC(=O)CSCc1ccccc1F 240690a_100020586998_100000150260 [0,1,0,0,0,1|1,1,0]=4 5853 B16R1.4473 C=CCNC(=O)CSCc1ccccc1F 527a_100020586998_100000150260 [0,1,0,0,0,1|1,1,0]=4 5854 B16R1.4473 C=CCNC(=O)CSCc1ccccc1F 62a_100000183597_100000211605 [0,1,0,0,0,1|1,1,0]=4 5855 B16R1.4473 C=CCNC(=O)CSCc1ccccc1F 62a_100000211605_100000183597 [0,1,0,0,0,1|1,1,0]=4 5856 B16R1.4473 C=CCNC(=O)CSCc1ccccc1I 62a_100000183597_100011216222 [0,1,0,0,0,1|1,1,0]=4 5857 B16R1.4473 C=CCNC(=O)CSCc1ccccc1I 62a_100011216222_100000183597 [0,1,0,0,0,1|1,1,0]=4 5858 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Br 2708a_100000747383_100020586998 [0,1,0,0,0,1|2,0,0]=4 5859 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Br 273464a_100000747383_100020586998 [0,1,0,0,0,1|2,0,0]=4 5860 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Br 273464a_100020586998_100000747383 [0,1,0,0,0,1|2,0,0]=4 5861 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Br 512a_100000747383_100020586998 [0,1,0,0,0,1|2,0,0]=4 5862 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Br 512a_100020586998_100000747383 [0,1,0,0,0,1|2,0,0]=4 5863 B16R1.4473 C=CCNC(=O)NCCc1ccccc1C 2708a_100000685071_100020586998 [0,1,0,0,0,1|2,0,0]=4 5864 B16R1.4473 C=CCNC(=O)NCCc1ccccc1C 273464a_100000685071_100020586998 [0,1,0,0,0,1|2,0,0]=4 5865 B16R1.4473 C=CCNC(=O)NCCc1ccccc1C 273464a_100020586998_100000685071 [0,1,0,0,0,1|2,0,0]=4 5866 B16R1.4473 C=CCNC(=O)NCCc1ccccc1C 512a_100000685071_100020586998 [0,1,0,0,0,1|2,0,0]=4 5867 B16R1.4473 C=CCNC(=O)NCCc1ccccc1C 512a_100020586998_100000685071 [0,1,0,0,0,1|2,0,0]=4 5868 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Cl 2708a_100011207228_100020586998 [0,1,0,0,0,1|2,0,0]=4 5869 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Cl 273464a_100011207228_100020586998 [0,1,0,0,0,1|2,0,0]=4 5870 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Cl 273464a_100020586998_100011207228 [0,1,0,0,0,1|2,0,0]=4 5871 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Cl 512a_100011207228_100020586998 [0,1,0,0,0,1|2,0,0]=4 5872 B16R1.4473 C=CCNC(=O)NCCc1ccccc1Cl 512a_100020586998_100011207228 [0,1,0,0,0,1|2,0,0]=4 5873 B16R1.4473 C=CCNC(=O)NCCc1ccccc1F 2708a_100000185272_100020586998 [0,1,0,0,0,1|2,0,0]=4 5874 B16R1.4473 C=CCNC(=O)NCCc1ccccc1F 273464a_100000185272_100020586998 [0,1,0,0,0,1|2,0,0]=4 5875 B16R1.4473 C=CCNC(=O)NCCc1ccccc1F 273464a_100020586998_100000185272 [0,1,0,0,0,1|2,0,0]=4 5876 B16R1.4473 C=CCNC(=O)NCCc1ccccc1F 512a_100000185272_100020586998 [0,1,0,0,0,1|2,0,0]=4 5877 B16R1.4473 C=CCNC(=O)NCCc1ccccc1F 512a_100020586998_100000185272 [0,1,0,0,0,1|2,0,0]=4 5878 B16R1.4473 C=CCNC(=O)NCCc1ccccc1O 2708a_100011207237_100020586998 [0,1,0,0,0,1|2,0,0]=4 5879 B16R1.4473 C=CCNC(=O)NCCc1ccccc1O 273464a_100011207237_100020586998 [0,1,0,0,0,1|2,0,0]=4 5880 B16R1.4473 C=CCNC(=O)NCCc1ccccc1O 273464a_100020586998_100011207237 [0,1,0,0,0,1|2,0,0]=4 5881 B16R1.4473 C=CCNC(=O)NCCc1ccccc1O 512a_100011207237_100020586998 [0,1,0,0,0,1|2,0,0]=4 5882 B16R1.4473 C=CCNC(=O)NCCc1ccccc1O 512a_100020586998_100011207237 [0,1,0,0,0,1|2,0,0]=4 5883 B16R1.4473 C=CCOC(=O)CNCc1ccccc1Br 2230a_100000689332_100000033060 [0,1,0,0,0,1|1,0,0]=3 5884 B16R1.4473 C=CCOC(=O)CNCc1ccccc1Br 34a_100000689332_100000033060 [0,1,0,0,0,1|1,0,0]=3 5885 B16R1.4473 C=CCOC(=O)CNCc1ccccc1C 34a_100000174972_100000033060 [0,1,0,0,0,1|1,0,0]=3 5886 B16R1.4473 C=CCOC(=O)CNCc1ccccc1Cl 2230a_100000174879_100000033060 [0,1,0,0,0,1|1,0,0]=3 5887 B16R1.4473 C=CCOC(=O)CNCc1ccccc1Cl 34a_100000174879_100000033060 [0,1,0,0,0,1|1,0,0]=3 5888 B16R1.4473 C=CCOC(=O)CNCc1ccccc1F 34a_100000174869_100000033060 [0,1,0,0,0,1|1,0,0]=3 5889 B16R1.4473 C=CCOC(=O)CNCc1ccccc1O 34a_100000185550_100000033060 [0,1,0,0,0,1|1,0,0]=3 5890 B16R1.4473 C=CCOC(=O)CNCc1cccnc1Br 2230a_100009818023_100000033060 [0,1,0,0,0,1|2,0,0]=4 5891 B16R1.4473 C=CCOC(=O)CNCc1cccnc1Br 34a_100009818023_100000033060 [0,1,0,0,0,1|2,0,0]=4 5892 B16R1.4473 C=CCOC(=O)CNCc1cccnc1Cl 2230a_100015189234_100000033060 [0,1,0,0,0,1|2,0,0]=4 5893 B16R1.4473 C=CCOC(=O)CNCc1cccnc1Cl 34a_100015189234_100000033060 [0,1,0,0,0,1|2,0,0]=4 5894 B16R1.4473 C=CCOC(=O)CNCc1cccnc1F 34a_100000724633_100000033060 [0,1,0,0,0,1|2,0,0]=4 5895 B16R1.4473 C=CCOC(=O)CNCc1ccncc1F 34a_100011935246_100000033060 [0,1,0,0,0,1|2,0,0]=4 5896 B16R1.4473 C=CCOC(=O)CNCc1ncccc1C 34a_100011223789_100000033060 [0,1,0,0,0,1|2,0,0]=4 5897 B16R1.4473 C=CCOC(=O)CNCc1ncccc1Cl 2230a_100015189233_100000033060 [0,1,0,0,0,1|2,0,0]=4 5898 B16R1.4473 C=CCOC(=O)CNCc1ncccc1F 34a_100000690088_100000033060 [0,1,0,0,0,1|2,0,0]=4 5899 B16R1.4473 C=CCOC(=O)COCc1ccccc1Br 34a_100000756307_100000033060 [0,1,0,0,0,1|0,0,0]=2 5900 B16R1.4473 C=CCOC(=O)COCc1ccccc1Br 7a_100000756307_100000033060 [0,1,0,0,0,1|0,0,0]=2 5901 B16R1.4473 C=CCOC(=O)COCc1ccccc1C 34a_100000698903_100000033060 [0,1,0,0,0,1|0,0,0]=2 5902 B16R1.4473 C=CCOC(=O)COCc1ccccc1C 7a_100000698903_100000033060 [0,1,0,0,0,1|0,0,0]=2 5903 B16R1.4473 C=CCOC(=O)COCc1ccccc1Cl 34a_100000210847_100000033060 [0,1,0,0,0,1|0,0,0]=2 5904 B16R1.4473 C=CCOC(=O)COCc1ccccc1Cl 7a_100000210847_100000033060 [0,1,0,0,0,1|0,0,0]=2 5905 B16R1.4473 C=CCOC(=O)COCc1ccccc1F 34a_100000211962_100000033060 [0,1,0,0,0,1|0,0,0]=2 5906 B16R1.4473 C=CCOC(=O)COCc1ccccc1F 7a_100000211962_100000033060 [0,1,0,0,0,1|0,0,0]=2 5907 B16R1.4473 C=CCOC(=O)COCc1ccccc1I 34a_100000187465_100000033060 [0,1,0,0,0,1|0,0,0]=2 5908 B16R1.4473 C=CCOC(=O)COCc1ccccc1I 7a_100000187465_100000033060 [0,1,0,0,0,1|0,0,0]=2 5909 B16R1.4473 C=CCOC(=O)COCc1ccccc1N 34a_100000212039_100000033060 [0,1,0,0,0,1|0,0,0]=2 5910 B16R1.4473 C=CCOC(=O)COCc1cccnc1Br 34a_100000719692_100000033060 [0,1,0,0,0,1|1,0,0]=3 5911 B16R1.4473 C=CCOC(=O)COCc1cccnc1Br 7a_100000719692_100000033060 [0,1,0,0,0,1|1,0,0]=3 5912 B16R1.4473 C=CCOC(=O)COCc1cccnc1C 34a_100000729262_100000033060 [0,1,0,0,0,1|1,0,0]=3 5913 B16R1.4473 C=CCOC(=O)COCc1cccnc1C 7a_100000729262_100000033060 [0,1,0,0,0,1|1,0,0]=3 5914 B16R1.4473 C=CCOC(=O)COCc1cccnc1Cl 34a_100000748726_100000033060 [0,1,0,0,0,1|1,0,0]=3 5915 B16R1.4473 C=CCOC(=O)COCc1cccnc1Cl 7a_100000748726_100000033060 [0,1,0,0,0,1|1,0,0]=3 5916 B16R1.4473 C=CCOC(=O)COCc1cccnc1F 34a_100000079888_100000033060 [0,1,0,0,0,1|1,0,0]=3 5917 B16R1.4473 C=CCOC(=O)COCc1cccnc1F 7a_100000079888_100000033060 [0,1,0,0,0,1|1,0,0]=3 5918 B16R1.4473 C=CCOC(=O)COCc1ccncc1C 34a_100011997032_100000033060 [0,1,0,0,0,1|1,0,0]=3 5919 B16R1.4473 C=CCOC(=O)COCc1ccncc1F 34a_100012172863_100000033060 [0,1,0,0,0,1|1,0,0]=3 5920 B16R1.4473 C=CCOC(=O)COCc1cnccc1C 34a_100011996381_100000033060 [0,1,0,0,0,1|1,0,0]=3 5921 B16R1.4473 C=CCOC(=O)COCc1cnccc1Cl 34a_100000117392_100000033060 [0,1,0,0,0,1|1,0,0]=3 5922 B16R1.4473 C=CCOC(=O)COCc1ncccc1Br 34a_100011996772_100000033060 [0,1,0,0,0,1|1,0,0]=3 5923 B16R1.4473 C=CCOC(=O)COCc1ncccc1C 34a_100000698912_100000033060 [0,1,0,0,0,1|1,0,0]=3 5924 B16R1.4473 C=CCOC(=O)COCc1ncccc1Cl 34a_100012002383_100000033060 [0,1,0,0,0,1|1,0,0]=3 5925 B16R1.4473 C=CCOC(=O)COCc1ncccc1F 34a_100011934865_100000033060 [0,1,0,0,0,1|1,0,0]=3 5926 B16R1.4473 C=CCOC(=O)COCc1ncccc1N 34a_114873767017_100000033060 [0,1,0,0,0,1|1,0,0]=3 5927 B16R1.4473 C=CCOC(=O)COCc1nccnc1Cl 34a_100000057004_100000033060 [0,1,0,0,0,1|2,0,0]=4 5928 B16R1.4473 C=CCOC(=O)CSCc1ccccc1Br 62a_100000033060_100000184730 [0,1,0,0,0,1|0,1,0]=3 5929 B16R1.4473 C=CCOC(=O)CSCc1ccccc1Br 62a_100000184730_100000033060 [0,1,0,0,0,1|0,1,0]=3 5930 B16R1.4473 C=CCOC(=O)CSCc1ccccc1C 62a_100000033060_100000211839 [0,1,0,0,0,1|0,1,0]=3 5931 B16R1.4473 C=CCOC(=O)CSCc1ccccc1C 62a_100000211839_100000033060 [0,1,0,0,0,1|0,1,0]=3 5932 B16R1.4473 C=CCOC(=O)CSCc1ccccc1Cl 62a_100000033060_100000187162 [0,1,0,0,0,1|0,1,0]=3 5933 B16R1.4473 C=CCOC(=O)CSCc1ccccc1Cl 62a_100000187162_100000033060 [0,1,0,0,0,1|0,1,0]=3 5934 B16R1.4473 C=CCOC(=O)CSCc1ccccc1F 62a_100000033060_100000211605 [0,1,0,0,0,1|0,1,0]=3 5935 B16R1.4473 C=CCOC(=O)CSCc1ccccc1F 62a_100000211605_100000033060 [0,1,0,0,0,1|0,1,0]=3 5936 B16R1.4473 C=CCOC(=O)CSCc1ccccc1I 62a_100000033060_100011216222 [0,1,0,0,0,1|0,1,0]=3 5937 B16R1.4473 C=CCOC(=O)CSCc1ccccc1I 62a_100011216222_100000033060 [0,1,0,0,0,1|0,1,0]=3 5938 B16R1.4473 C=CCOC(=O)CSCc1cccnc1Br 62a_100000033060_100010140945 [0,1,0,0,0,1|1,1,0]=4 5939 B16R1.4473 C=CCOC(=O)CSCc1cccnc1Br 62a_100010140945_100000033060 [0,1,0,0,0,1|1,1,0]=4 5940 B16R1.4473 C=CCOC(=O)CSCc1cccnc1C 62a_100000033060_100000732876 [0,1,0,0,0,1|1,1,0]=4 5941 B16R1.4473 C=CCOC(=O)CSCc1cccnc1C 62a_100000732876_100000033060 [0,1,0,0,0,1|1,1,0]=4 5942 B16R1.4473 C=CCOC(=O)CSCc1cccnc1Cl 62a_100000033060_100000045678 [0,1,0,0,0,1|1,1,0]=4 5943 B16R1.4473 C=CCOC(=O)CSCc1cccnc1Cl 62a_100000045678_100000033060 [0,1,0,0,0,1|1,1,0]=4 5944 B16R1.4473 C=CCOC(=O)CSCc1cccnc1F 62a_100000033060_100000099810 [0,1,0,0,0,1|1,1,0]=4 5945 B16R1.4473 C=CCOC(=O)CSCc1cccnc1F 62a_100000099810_100000033060 [0,1,0,0,0,1|1,1,0]=4 5946 B16R1.4473 C=CCOC(=O)CSCc1ccncc1C 62a_100000033060_100020672808 [0,1,0,0,0,1|1,1,0]=4 5947 B16R1.4473 C=CCOC(=O)CSCc1ccncc1C 62a_100020672808_100000033060 [0,1,0,0,0,1|1,1,0]=4 5948 B16R1.4473 C=CCOC(=O)CSCc1ccncc1Cl 62a_100000033060_100000763264 [0,1,0,0,0,1|1,1,0]=4 5949 B16R1.4473 C=CCOC(=O)CSCc1ccncc1Cl 62a_100000763264_100000033060 [0,1,0,0,0,1|1,1,0]=4 5950 B16R1.4473 C=CCOC(=O)CSCc1cnccc1C 62a_100000033060_100000690890 [0,1,0,0,0,1|1,1,0]=4 5951 B16R1.4473 C=CCOC(=O)CSCc1cnccc1C 62a_100000690890_100000033060 [0,1,0,0,0,1|1,1,0]=4 5952 B16R1.4473 C=CCOC(=O)CSCc1ncccc1Br 62a_100000033060_100025702911 [0,1,0,0,0,1|1,1,0]=4 5953 B16R1.4473 C=CCOC(=O)CSCc1ncccc1Br 62a_100025702911_100000033060 [0,1,0,0,0,1|1,1,0]=4 5954 B16R1.4473 C=CCOC(=O)CSCc1ncccc1C 62a_100000033060_100000696600 [0,1,0,0,0,1|1,1,0]=4 5955 B16R1.4473 C=CCOC(=O)CSCc1ncccc1C 62a_100000696600_100000033060 [0,1,0,0,0,1|1,1,0]=4 5956 B16R1.4473 C=CCOC(=O)CSCc1ncccc1Cl 62a_100000033060_100000099807 [0,1,0,0,0,1|1,1,0]=4 5957 B16R1.4473 C=CCOC(=O)CSCc1ncccc1Cl 62a_100000099807_100000033060 [0,1,0,0,0,1|1,1,0]=4 5958 B16R1.4473 C=CCOC(=O)CSCc1ncccc1F 62a_100000033060_100000104219 [0,1,0,0,0,1|1,1,0]=4 5959 B16R1.4473 C=CCOC(=O)CSCc1ncccc1F 62a_100000104219_100000033060 [0,1,0,0,0,1|1,1,0]=4 5960 B16R1.4473 C=CCOC(=O)CSCc1ncccc1O 62a_100000033060_200020655725 [0,1,0,0,0,1|1,1,0]=4 5961 B16R1.4473 C=CCOC(=O)CSCc1ncccc1O 62a_200020655725_100000033060 [0,1,0,0,0,1|1,1,0]=4 5962 B16R1.4473 CCCOC(=O)COCc1ccccc1Br 34a_100000756307_200011215008 [0,1,0,0,0,1|0,0,2]=4 5963 B16R1.4473 CCCOC(=O)COCc1ccccc1Br 7a_100000756307_200011215008 [0,1,0,0,0,1|0,0,2]=4 5964 B16R1.4473 CCCOC(=O)COCc1ccccc1C 34a_100000698903_200011215008 [0,1,0,0,0,1|0,0,2]=4 5965 B16R1.4473 CCCOC(=O)COCc1ccccc1C 7a_100000698903_200011215008 [0,1,0,0,0,1|0,0,2]=4 5966 B16R1.4473 CCCOC(=O)COCc1ccccc1Cl 34a_100000210847_200011215008 [0,1,0,0,0,1|0,0,2]=4 5967 B16R1.4473 CCCOC(=O)COCc1ccccc1Cl 7a_100000210847_200011215008 [0,1,0,0,0,1|0,0,2]=4 5968 B16R1.4473 CCCOC(=O)COCc1ccccc1F 34a_100000211962_200011215008 [0,1,0,0,0,1|0,0,2]=4 5969 B16R1.4473 CCCOC(=O)COCc1ccccc1F 7a_100000211962_200011215008 [0,1,0,0,0,1|0,0,2]=4 5970 B16R1.4473 CCCOC(=O)COCc1ccccc1I 34a_100000187465_200011215008 [0,1,0,0,0,1|0,0,2]=4 5971 B16R1.4473 CCCOC(=O)COCc1ccccc1I 7a_100000187465_200011215008 [0,1,0,0,0,1|0,0,2]=4 5972 B16R1.4473 CCCOC(=O)COCc1ccccc1N 34a_100000212039_200011215008 [0,1,0,0,0,1|0,0,2]=4 5973 B16R1.4473 CCCOC(=O)OCOc1ccccc1Br 34a_100000181306_200000139673 [0,1,0,0,0,1|0,0,2]=4 5974 B16R1.4473 CCCOC(=O)OCOc1ccccc1Br 7a_100000181306_200000139673 [0,1,0,0,0,1|0,0,2]=4 5975 B16R1.4473 CCCOC(=O)OCOc1ccccc1C 34a_100000210338_200000139673 [0,1,0,0,0,1|0,0,2]=4 5976 B16R1.4473 CCCOC(=O)OCOc1ccccc1C 7a_100000210338_200000139673 [0,1,0,0,0,1|0,0,2]=4 5977 B16R1.4473 CCCOC(=O)OCOc1ccccc1Cl 34a_100000210172_200000139673 [0,1,0,0,0,1|0,0,2]=4 5978 B16R1.4473 CCCOC(=O)OCOc1ccccc1Cl 7a_100000210172_200000139673 [0,1,0,0,0,1|0,0,2]=4 5979 B16R1.4473 CCCOC(=O)OCOc1ccccc1F 34a_100000210171_200000139673 [0,1,0,0,0,1|0,0,2]=4 5980 B16R1.4473 CCCOC(=O)OCOc1ccccc1F 7a_100000210171_200000139673 [0,1,0,0,0,1|0,0,2]=4 5981 B16R1.4473 CCCOC(=O)OCOc1ccccc1I 34a_100000739446_200000139673 [0,1,0,0,0,1|0,0,2]=4 5982 B16R1.4473 CCCOC(=O)OCOc1ccccc1I 7a_100000739446_200000139673 [0,1,0,0,0,1|0,0,2]=4 5983 B16R1.4473 CCCOC(=O)OCOc1ccccc1N 34a_100000185747_200000139673 [0,1,0,0,0,1|0,0,2]=4 5984 B16R1.4473 CCCOC(=O)OCOc1ccccc1N 7a_100000185747_200000139673 [0,1,0,0,0,1|0,0,2]=4 5985 B16R1.14049 C=CCC(C)C(=O)C/C=C/c1ccccc1 1458a_100011216819_100016265936 [0,1,0,0,0,1|2,0,0]=4 5986 B16R1.14049 C=CCC(C)C(=O)CC#Cc1ccccc1 1458a_100011216819_100011352542 [0,1,0,0,0,1|2,0,0]=4 5987 B16R1.14049 C=CCC(C)C(=O)CCCc1ccccc1 1458a_100011216819_100000211621 [0,1,0,0,0,1|2,0,0]=4 5988 B16R1.14049 C=CCC(C)C(=O)CCOc1ccccc1 1458a_100011216819_100000184471 [0,1,0,0,0,1|1,0,0]=3 5989 B16R1.14049 C=CCC(C)C(=O)CCSc1ccccc1 1458a_100011216819_100000246102 [0,1,0,0,0,1|1,1,0]=4 5990 B16R1.14049 C=CCC(C)C(=O)CSCc1ccccc1 1458a_100011216819_200011217039 [0,1,0,0,0,1|1,1,0]=4 5991 B16R1.14049 C=CCC(C)C(=O)NCCc1ccccc1 11a_100000106460_100011216819 [0,1,0,0,0,1|2,0,0]=4 5992 B16R1.14049 C=CCC(C)C(=O)NCCc1ccccc1 1626a_100000106460_100011216819 [0,1,0,0,0,1|2,0,0]=4 5993 B16R1.14049 C=CCC(C)C(=O)NCCc1ccccc1 240690a_100000106460_100011216819 [0,1,0,0,0,1|2,0,0]=4 5994 B16R1.14049 C=CCC(C)C(=O)NCCc1ccccc1 527a_100000106460_100011216819 [0,1,0,0,0,1|2,0,0]=4 5995 B16R1.14049 C=CCN(C)C(=O)C/C=C/c1ccccc1 11a_100000225617_100011219626 [0,1,0,0,0,1|2,0,0]=4 5996 B16R1.14049 C=CCN(C)C(=O)C/C=C/c1ccccc1 1626a_100000225617_100011219626 [0,1,0,0,0,1|2,0,0]=4 5997 B16R1.14049 C=CCN(C)C(=O)C/C=C/c1ccccc1 240690a_100000225617_100011219626 [0,1,0,0,0,1|2,0,0]=4 5998 B16R1.14049 C=CCN(C)C(=O)CCCc1ccccc1 11a_100000225617_100011207963 [0,1,0,0,0,1|2,0,0]=4 5999 B16R1.14049 C=CCN(C)C(=O)CCCc1ccccc1 1626a_100000225617_100011207963 [0,1,0,0,0,1|2,0,0]=4 6000 B16R1.14049 C=CCN(C)C(=O)CCCc1ccccc1 240690a_100000225617_100011207963 [0,1,0,0,0,1|2,0,0]=4 6001 B16R1.14049 C=CCN(C)C(=O)CCCc1ccccc1 527a_100000225617_100011207963 [0,1,0,0,0,1|2,0,0]=4 6002 B16R1.14049 C=CCN(C)C(=O)CCOc1ccccc1 11a_100000225617_100000182761 [0,1,0,0,0,1|1,0,0]=3 6003 B16R1.14049 C=CCN(C)C(=O)CCOc1ccccc1 1626a_100000225617_100000182761 [0,1,0,0,0,1|1,0,0]=3 6004 B16R1.14049 C=CCN(C)C(=O)CCOc1ccccc1 240690a_100000225617_100000182761 [0,1,0,0,0,1|1,0,0]=3 6005 B16R1.14049 C=CCN(C)C(=O)CCSc1ccccc1 11a_100000225617_100000182436 [0,1,0,0,0,1|1,1,0]=4 6006 B16R1.14049 C=CCN(C)C(=O)CCSc1ccccc1 1626a_100000225617_100000182436 [0,1,0,0,0,1|1,1,0]=4 6007 B16R1.14049 C=CCN(C)C(=O)CCSc1ccccc1 240690a_100000225617_100000182436 [0,1,0,0,0,1|1,1,0]=4 6008 B16R1.14049 C=CCN(C)C(=O)COCc1ccccc1 11a_100000225617_100000230186 [0,1,0,0,0,1|1,0,0]=3 6009 B16R1.14049 C=CCN(C)C(=O)COCc1ccccc1 1626a_100000225617_100000230186 [0,1,0,0,0,1|1,0,0]=3 6010 B16R1.14049 C=CCN(C)C(=O)COCc1ccccc1 240690a_100000225617_100000230186 [0,1,0,0,0,1|1,0,0]=3 6011 B16R1.14049 C=CCN(C)C(=O)COCc1ccccc1 527a_100000225617_100000230186 [0,1,0,0,0,1|1,0,0]=3 6012 B16R1.14049 C=CCN(C)C(=O)CSCc1ccccc1 11a_100000225617_100000150264 [0,1,0,0,0,1|1,1,0]=4 6013 B16R1.14049 C=CCN(C)C(=O)CSCc1ccccc1 1626a_100000225617_100000150264 [0,1,0,0,0,1|1,1,0]=4 6014 B16R1.14049 C=CCN(C)C(=O)CSCc1ccccc1 240690a_100000225617_100000150264 [0,1,0,0,0,1|1,1,0]=4 6015 B16R1.14049 C=CCN(C)C(=O)CSCc1ccccc1 527a_100000225617_100000150264 [0,1,0,0,0,1|1,1,0]=4 6016 B16R1.14049 C=CCN(C)C(=O)NCCc1ccccc1 2708a_100000106460_100000225617 [0,1,0,0,0,1|2,0,0]=4 6017 B16R1.14049 C=CCN(C)C(=O)NCCc1ccccc1 273464a_100000106460_100000225617 [0,1,0,0,0,1|2,0,0]=4 6018 B16R1.17844 C=CCNS(=O)(=O)CCOc1ccccc1 270084a_100020586998_100000750344 [0,1,0,0,0,1|2,0,0]=4 6019 B16R1.17844 C=CCNS(=O)(=O)CCOc1ccccc1 274078a_100020586998_100000750344 [0,1,0,0,0,1|2,0,0]=4 6020 B16R1.18213 C=C(C)CCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000730704 [0,1,0,0,0,1|2,0,0]=4 6021 B16R1.18213 C=C(C)CCC(=O)C/C=C/c1ccccc1 1458a_200000688413_100016265936 [0,1,0,0,0,1|2,0,0]=4 6022 B16R1.18213 C=C(C)CCC(=O)CC#Cc1ccccc1 1458a_200000688413_100011352542 [0,1,0,0,0,1|2,0,0]=4 6023 B16R1.18213 C=C(C)CCC(=O)CCCc1ccccc1 1458a_100011207963_100000730704 [0,1,0,0,0,1|2,0,0]=4 6024 B16R1.18213 C=C(C)CCC(=O)CCCc1ccccc1 1458a_200000688413_100000211621 [0,1,0,0,0,1|2,0,0]=4 6025 B16R1.18213 C=C(C)CCC(=O)CCOc1ccccc1 1458a_100000182761_100000730704 [0,1,0,0,0,1|1,0,0]=3 6026 B16R1.18213 C=C(C)CCC(=O)CCOc1ccccc1 1458a_200000688413_100000184471 [0,1,0,0,0,1|1,0,0]=3 6027 B16R1.18213 C=C(C)CCC(=O)CCSc1ccccc1 1458a_100000182436_100000730704 [0,1,0,0,0,1|1,1,0]=4 6028 B16R1.18213 C=C(C)CCC(=O)CCSc1ccccc1 1458a_200000688413_100000246102 [0,1,0,0,0,1|1,1,0]=4 6029 B16R1.18213 C=C(C)CCC(=O)COCc1ccccc1 1458a_100000230186_100000730704 [0,1,0,0,0,1|1,0,0]=3 6030 B16R1.18213 C=C(C)CCC(=O)CSCc1ccccc1 1458a_100000150264_100000730704 [0,1,0,0,0,1|1,1,0]=4 6031 B16R1.18213 C=C(C)CCC(=O)CSCc1ccccc1 1458a_200000688413_200011217039 [0,1,0,0,0,1|1,1,0]=4 6032 B16R1.18213 C=C(C)CCC(=O)NCCc1ccccc1 11a_100000106460_200000688413 [0,1,0,0,0,1|2,0,0]=4 6033 B16R1.18213 C=C(C)CCC(=O)NCCc1ccccc1 1626a_100000106460_200000688413 [0,1,0,0,0,1|2,0,0]=4 6034 B16R1.18213 C=C(C)CCC(=O)NCCc1ccccc1 240690a_100000106460_200000688413 [0,1,0,0,0,1|2,0,0]=4 6035 B16R1.18213 C=C(C)CCC(=O)NCCc1ccccc1 527a_100000106460_200000688413 [0,1,0,0,0,1|2,0,0]=4 6036 B16R1.18213 C=C(C)CNC(=O)C/C=C/c1ccccc1 11a_100000765925_100011219626 [0,1,0,0,0,1|2,0,0]=4 6037 B16R1.18213 C=C(C)CNC(=O)C/C=C/c1ccccc1 1626a_100000765925_100011219626 [0,1,0,0,0,1|2,0,0]=4 6038 B16R1.18213 C=C(C)CNC(=O)C/C=C/c1ccccc1 240690a_100000765925_100011219626 [0,1,0,0,0,1|2,0,0]=4 6039 B16R1.18213 C=C(C)CNC(=O)CCCc1ccccc1 11a_100000765925_100011207963 [0,1,0,0,0,1|2,0,0]=4 6040 B16R1.18213 C=C(C)CNC(=O)CCCc1ccccc1 1626a_100000765925_100011207963 [0,1,0,0,0,1|2,0,0]=4 6041 B16R1.18213 C=C(C)CNC(=O)CCCc1ccccc1 240690a_100000765925_100011207963 [0,1,0,0,0,1|2,0,0]=4 6042 B16R1.18213 C=C(C)CNC(=O)CCCc1ccccc1 527a_100000765925_100011207963 [0,1,0,0,0,1|2,0,0]=4 6043 B16R1.18213 C=C(C)CNC(=O)CCOc1ccccc1 11a_100000765925_100000182761 [0,1,0,0,0,1|1,0,0]=3 6044 B16R1.18213 C=C(C)CNC(=O)CCOc1ccccc1 1626a_100000765925_100000182761 [0,1,0,0,0,1|1,0,0]=3 6045 B16R1.18213 C=C(C)CNC(=O)CCOc1ccccc1 240690a_100000765925_100000182761 [0,1,0,0,0,1|1,0,0]=3 6046 B16R1.18213 C=C(C)CNC(=O)CCSc1ccccc1 11a_100000765925_100000182436 [0,1,0,0,0,1|1,1,0]=4 6047 B16R1.18213 C=C(C)CNC(=O)CCSc1ccccc1 1626a_100000765925_100000182436 [0,1,0,0,0,1|1,1,0]=4 6048 B16R1.18213 C=C(C)CNC(=O)CCSc1ccccc1 240690a_100000765925_100000182436 [0,1,0,0,0,1|1,1,0]=4 6049 B16R1.18213 C=C(C)CNC(=O)COCc1ccccc1 11a_100000765925_100000230186 [0,1,0,0,0,1|1,0,0]=3 6050 B16R1.18213 C=C(C)CNC(=O)COCc1ccccc1 1626a_100000765925_100000230186 [0,1,0,0,0,1|1,0,0]=3 6051 B16R1.18213 C=C(C)CNC(=O)COCc1ccccc1 240690a_100000765925_100000230186 [0,1,0,0,0,1|1,0,0]=3 6052 B16R1.18213 C=C(C)CNC(=O)COCc1ccccc1 527a_100000765925_100000230186 [0,1,0,0,0,1|1,0,0]=3 6053 B16R1.18213 C=C(C)CNC(=O)CSCc1ccccc1 11a_100000765925_100000150264 [0,1,0,0,0,1|1,1,0]=4 6054 B16R1.18213 C=C(C)CNC(=O)CSCc1ccccc1 1626a_100000765925_100000150264 [0,1,0,0,0,1|1,1,0]=4 6055 B16R1.18213 C=C(C)CNC(=O)CSCc1ccccc1 240690a_100000765925_100000150264 [0,1,0,0,0,1|1,1,0]=4 6056 B16R1.18213 C=C(C)CNC(=O)CSCc1ccccc1 527a_100000765925_100000150264 [0,1,0,0,0,1|1,1,0]=4 6057 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 2708a_100000106460_100000765925 [0,1,0,0,0,1|2,0,0]=4 6058 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 2708a_100000765925_100000106460 [0,1,0,0,0,1|2,0,0]=4 6059 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 273464a_100000106460_100000765925 [0,1,0,0,0,1|2,0,0]=4 6060 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 273464a_100000765925_100000106460 [0,1,0,0,0,1|2,0,0]=4 6061 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 512a_100000106460_100000765925 [0,1,0,0,0,1|2,0,0]=4 6062 B16R1.18213 C=C(C)CNC(=O)NCCc1ccccc1 512a_100000765925_100000106460 [0,1,0,0,0,1|2,0,0]=4 6063 B16R1.18213 C=C(C)COC(C)COCc1ccccc1 34a_100000764311_100000748629 [0,1,0,0,0,1|1,0,1]=4 6064 B16R1.18213 C=C(C)COC(C)COCc1ccccc1 7a_100000764311_100000748629 [0,1,0,0,0,1|1,0,1]=4 6065 B16R1.18213 C=C(F)COC(C)COCc1ccccc1 34a_100000764311_100009893438 [0,1,0,0,0,1|1,0,1]=4 6066 B16R1.18213 C=C(F)COC(C)COCc1ccccc1 7a_100000764311_100000042424 [0,1,0,0,0,1|1,0,1]=4 6067 B16R1.18213 NC(=O)CCC(=O)CCOc1ccccc1 1458a_100011215257_100000184471 [0,1,0,0,0,1|2,0,0]=4 6068 B16R1.18213 NC(=O)CNC(=O)CCOc1ccccc1 11a_100000711301_100000182761 [0,1,0,0,0,1|2,0,0]=4 6069 B16R1.18213 NC(=O)CNC(=O)CCOc1ccccc1 240690a_100000711301_100000182761 [0,1,0,0,0,1|2,0,0]=4 6070 B16R1.18213 NC(=O)CNC(=O)COCc1ccccc1 11a_100000711301_100000230186 [0,1,0,0,0,1|2,0,0]=4 6071 B16R1.18213 NC(=O)CNC(=O)COCc1ccccc1 240690a_100000711301_100000230186 [0,1,0,0,0,1|2,0,0]=4 6072 B16R1.18213 NC(=O)CNC(=O)COCc1ccccc1 527a_100000711301_100000230186 [0,1,0,0,0,1|2,0,0]=4 6073 B16R1.1453 C=CCNC(=O)COc1cccccc1=O 7a_100000036025_100000183597 [0,1,0,0,0,1|1,0,0]=3 6074 B16R1.1453 C=CCOC(=O)COc1cccccc1=O 34a_100000036025_100000033060 [0,1,0,0,0,1|0,0,0]=2 6075 B16R1.1453 C=CCOC(=O)COc1cccccc1=O 7a_100000036025_100000033060 [0,1,0,0,0,1|0,0,0]=2 6076 B16R1.1453 CCCOC(=O)COc1cccccc1=O 34a_100000036025_200011215008 [0,1,0,0,0,1|0,0,2]=4 6077 B16R1.1453 CCCOC(=O)COc1cccccc1=O 7a_100000036025_200011215008 [0,1,0,0,0,1|0,0,2]=4 6078 B16R1.35 C=CCCCC(=O)CC(=O)c1ccccc1 1458a_100000766728_100000211460 [0,2,0,0,0,0|2,0,0]=4 6079 B16R1.35 C=CCCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000757094 [0,2,0,0,0,0|2,0,0]=4 6080 B16R1.35 C=CCCCC(=O)CC(C)c1ccccc1 1458a_100000766728_100000756946 [0,2,0,0,0,0|2,0,0]=4 6081 B16R1.35 C=CCCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000757094 [0,2,0,0,0,0|2,0,0]=4 6082 B16R1.35 C=CCCCC(=O)CC(O)c1ccccc1 1458a_100000766728_100000185958 [0,2,0,0,0,0|2,0,0]=4 6083 B16R1.35 C=CCCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000757094 [0,2,0,0,0,0|2,0,0]=4 6084 B16R1.35 C=CCCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000766728_100011933945 [0,2,0,0,0,0|2,0,0]=4 6085 B16R1.35 C=CCCNC(=O)CC(C)c1ccccc1 11a_100015191253_100000183687 [0,2,0,0,0,0|2,0,0]=4 6086 B16R1.35 C=CCCNC(=O)CC(C)c1ccccc1 1626a_100015191253_100000183687 [0,2,0,0,0,0|2,0,0]=4 6087 B16R1.35 C=CCCNC(=O)CC(C)c1ccccc1 240690a_100015191253_100000183687 [0,2,0,0,0,0|2,0,0]=4 6088 B16R1.35 C=CCCNC(=O)CC(C)c1ccccc1 527a_100015191253_100000183687 [0,2,0,0,0,0|2,0,0]=4 6089 B16R1.35 C=CCCNC(=O)CC(O)c1ccccc1 240690a_100015191253_100000690199 [0,2,0,0,0,0|2,0,0]=4 6090 B16R1.35 C=CCCNC(=O)CN(C)c1ccccc1 240690a_100015191253_100000745425 [0,2,0,0,0,0|2,0,0]=4 6091 B16R1.35 C=CCCNC(=O)CN(C)c1ccccc1 527a_100015191253_100000745425 [0,2,0,0,0,0|2,0,0]=4 6092 B16R1.35 C=CCNNC(=O)CC(C)c1ccccc1 22a_100020588587_100000183687 [0,2,0,0,0,0|2,0,0]=4 6093 B16R1.35 C=CCNNC(=O)CC(O)c1ccccc1 22a_100020588587_100000690199 [0,2,0,0,0,0|2,0,0]=4 6094 B16R1.35 C=CCNNC(=O)CN(C)c1ccccc1 22a_100020588587_100000745425 [0,2,0,0,0,0|2,0,0]=4 6095 B16R1.35 C=CCOCC(=O)NC(C)c1ccccc1 34a_200000210373_200000243715 [0,2,0,0,0,0|2,0,0]=4 6096 B16R1.35 C=CCOCC(=O)N[C@@H](C)c1ccccc1 34a_200000210373_100011939912 [0,2,0,0,0,0|2,0,0]=4 6097 B16R1.35 C=CCSCC(=O)CC(=O)c1ccccc1 1458a_100000230395_100000211460 [0,2,0,0,0,0|1,1,0]=4 6098 B16R1.35 C=CCSCC(=O)CC(C)c1ccccc1 1458a_100000230395_100000756946 [0,2,0,0,0,0|1,1,0]=4 6099 B16R1.35 C=CCSCC(=O)CC(O)c1ccccc1 1458a_100000230395_100000185958 [0,2,0,0,0,0|1,1,0]=4 6100 B16R1.35 C=CCSCC(=O)C[C@@H](O)c1ccccc1 1458a_100000230395_100011933945 [0,2,0,0,0,0|1,1,0]=4 6101 B16R1.35 C=COCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000039644 [0,2,0,0,0,0|2,0,0]=4 6102 B16R1.35 C=COCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000039644 [0,2,0,0,0,0|2,0,0]=4 6103 B16R1.35 C=COCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000039644 [0,2,0,0,0,0|2,0,0]=4 6104 B16R1.51 C/C=C/COC(C)COc1ccc(cc1)C 34a_100011217472_100102629194 [0,2,0,0,0,0|1,0,1]=4 6105 B16R1.51 C/C=C/COC(C)COc1ccc(cc1)C 7a_100011217472_100102629194 [0,2,0,0,0,0|1,0,1]=4 6106 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000757094 [0,2,0,0,0,0|2,0,0]=4 6107 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)Br 1458a_100000766728_100011740612 [0,2,0,0,0,0|2,0,0]=4 6108 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000757094 [0,2,0,0,0,0|2,0,0]=4 6109 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)C 1458a_100000766728_100011713686 [0,2,0,0,0,0|2,0,0]=4 6110 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000757094 [0,2,0,0,0,0|2,0,0]=4 6111 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000766728_100011713675 [0,2,0,0,0,0|2,0,0]=4 6112 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000757094 [0,2,0,0,0,0|2,0,0]=4 6113 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)F 1458a_100000766728_100011217392 [0,2,0,0,0,0|2,0,0]=4 6114 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000757094 [0,2,0,0,0,0|2,0,0]=4 6115 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000757094 [0,2,0,0,0,0|2,0,0]=4 6116 B16R1.51 C=CCCCC(=O)CCc1ccc(cc1)O 1458a_100000766728_100009816426 [0,2,0,0,0,0|2,0,0]=4 6117 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000757094 [0,2,0,0,0,0|1,0,0]=3 6118 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000757094 [0,2,0,0,0,0|1,0,0]=3 6119 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000757094 [0,2,0,0,0,0|1,0,0]=3 6120 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000757094 [0,2,0,0,0,0|1,0,0]=3 6121 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000757094 [0,2,0,0,0,0|1,0,0]=3 6122 B16R1.51 C=CCCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000757094 [0,2,0,0,0,0|1,0,0]=3 6123 B16R1.51 C=CCCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000757094 [0,2,0,0,0,0|1,1,0]=4 6124 B16R1.51 C=CCCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000757094 [0,2,0,0,0,0|1,1,0]=4 6125 B16R1.51 C=CCCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000757094 [0,2,0,0,0,0|1,1,0]=4 6126 B16R1.51 C=CCCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000757094 [0,2,0,0,0,0|1,1,0]=4 6127 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Br 11a_100015191253_100000217147 [0,2,0,0,0,0|2,0,0]=4 6128 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Br 1626a_100015191253_100000217147 [0,2,0,0,0,0|2,0,0]=4 6129 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Br 240690a_100015191253_100000217147 [0,2,0,0,0,0|2,0,0]=4 6130 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Br 527a_100015191253_100000217147 [0,2,0,0,0,0|2,0,0]=4 6131 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)C 11a_100015191253_100000234883 [0,2,0,0,0,0|2,0,0]=4 6132 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)C 1626a_100015191253_100000234883 [0,2,0,0,0,0|2,0,0]=4 6133 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)C 240690a_100015191253_100000234883 [0,2,0,0,0,0|2,0,0]=4 6134 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)C 527a_100015191253_100000234883 [0,2,0,0,0,0|2,0,0]=4 6135 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Cl 11a_100015191253_100000235379 [0,2,0,0,0,0|2,0,0]=4 6136 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Cl 1626a_100015191253_100000235379 [0,2,0,0,0,0|2,0,0]=4 6137 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Cl 240690a_100015191253_100000235379 [0,2,0,0,0,0|2,0,0]=4 6138 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)Cl 527a_100015191253_100000235379 [0,2,0,0,0,0|2,0,0]=4 6139 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)F 11a_100015191253_100000198493 [0,2,0,0,0,0|2,0,0]=4 6140 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)F 1626a_100015191253_100000198493 [0,2,0,0,0,0|2,0,0]=4 6141 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)F 240690a_100015191253_100000198493 [0,2,0,0,0,0|2,0,0]=4 6142 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)F 527a_100015191253_100000198493 [0,2,0,0,0,0|2,0,0]=4 6143 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)I 11a_100015191253_100011217499 [0,2,0,0,0,0|2,0,0]=4 6144 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)I 1626a_100015191253_100011217499 [0,2,0,0,0,0|2,0,0]=4 6145 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)I 240690a_100015191253_100011217499 [0,2,0,0,0,0|2,0,0]=4 6146 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)I 527a_100015191253_100011217499 [0,2,0,0,0,0|2,0,0]=4 6147 B16R1.51 C=CCCNC(=O)CCc1ccc(cc1)O 240690a_100015191253_100000742835 [0,2,0,0,0,0|2,0,0]=4 6148 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Br 11a_100015191253_100000182358 [0,2,0,0,0,0|1,0,0]=3 6149 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Br 1626a_100015191253_100000182358 [0,2,0,0,0,0|1,0,0]=3 6150 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Br 240690a_100015191253_100000182358 [0,2,0,0,0,0|1,0,0]=3 6151 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Br 527a_100015191253_100000182358 [0,2,0,0,0,0|1,0,0]=3 6152 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)C 11a_100015191253_100000182360 [0,2,0,0,0,0|1,0,0]=3 6153 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)C 1626a_100015191253_100000182360 [0,2,0,0,0,0|1,0,0]=3 6154 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)C 240690a_100015191253_100000182360 [0,2,0,0,0,0|1,0,0]=3 6155 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)C 527a_100015191253_100000182360 [0,2,0,0,0,0|1,0,0]=3 6156 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Cl 11a_100015191253_100016990877 [0,2,0,0,0,0|1,0,0]=3 6157 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Cl 1626a_100015191253_100016990877 [0,2,0,0,0,0|1,0,0]=3 6158 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Cl 240690a_100015191253_100016990877 [0,2,0,0,0,0|1,0,0]=3 6159 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)Cl 527a_100015191253_100016990877 [0,2,0,0,0,0|1,0,0]=3 6160 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)F 11a_100015191253_100000184765 [0,2,0,0,0,0|1,0,0]=3 6161 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)F 1626a_100015191253_100000184765 [0,2,0,0,0,0|1,0,0]=3 6162 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)F 240690a_100015191253_100000184765 [0,2,0,0,0,0|1,0,0]=3 6163 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)F 527a_100015191253_100000184765 [0,2,0,0,0,0|1,0,0]=3 6164 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)I 11a_100015191253_100000184369 [0,2,0,0,0,0|1,0,0]=3 6165 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)I 1626a_100015191253_100000184369 [0,2,0,0,0,0|1,0,0]=3 6166 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)I 240690a_100015191253_100000184369 [0,2,0,0,0,0|1,0,0]=3 6167 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)I 527a_100015191253_100000184369 [0,2,0,0,0,0|1,0,0]=3 6168 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)O 240690a_100015191253_100000031633 [0,2,0,0,0,0|1,0,0]=3 6169 B16R1.51 C=CCCNC(=O)COc1ccc(cc1)O 527a_100015191253_100000031633 [0,2,0,0,0,0|1,0,0]=3 6170 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Br 11a_100015191253_100000179496 [0,2,0,0,0,0|1,1,0]=4 6171 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Br 1626a_100015191253_100000179496 [0,2,0,0,0,0|1,1,0]=4 6172 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Br 240690a_100015191253_100000179496 [0,2,0,0,0,0|1,1,0]=4 6173 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Br 527a_100015191253_100000179496 [0,2,0,0,0,0|1,1,0]=4 6174 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)C 11a_100015191253_100000179497 [0,2,0,0,0,0|1,1,0]=4 6175 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)C 1626a_100015191253_100000179497 [0,2,0,0,0,0|1,1,0]=4 6176 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)C 240690a_100015191253_100000179497 [0,2,0,0,0,0|1,1,0]=4 6177 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)C 527a_100015191253_100000179497 [0,2,0,0,0,0|1,1,0]=4 6178 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Cl 11a_100015191253_100000178402 [0,2,0,0,0,0|1,1,0]=4 6179 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Cl 1626a_100015191253_100000178402 [0,2,0,0,0,0|1,1,0]=4 6180 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Cl 240690a_100015191253_100000178402 [0,2,0,0,0,0|1,1,0]=4 6181 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)Cl 527a_100015191253_100000178402 [0,2,0,0,0,0|1,1,0]=4 6182 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)F 11a_100015191253_100000691584 [0,2,0,0,0,0|1,1,0]=4 6183 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)F 1626a_100015191253_100000691584 [0,2,0,0,0,0|1,1,0]=4 6184 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)F 240690a_100015191253_100000691584 [0,2,0,0,0,0|1,1,0]=4 6185 B16R1.51 C=CCCNC(=O)CSc1ccc(cc1)F 527a_100015191253_100000691584 [0,2,0,0,0,0|1,1,0]=4 6186 B16R1.51 C=CCCOC(C)COc1ccc(cc1)C 34a_100011217472_100000754431 [0,2,0,0,0,0|1,0,1]=4 6187 B16R1.51 C=CCCOC(C)COc1ccc(cc1)C 7a_100011217472_100000754431 [0,2,0,0,0,0|1,0,1]=4 6188 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)Br 22a_100020588587_100000217147 [0,2,0,0,0,0|2,0,0]=4 6189 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)C 22a_100020588587_100000234883 [0,2,0,0,0,0|2,0,0]=4 6190 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)Cl 22a_100020588587_100000235379 [0,2,0,0,0,0|2,0,0]=4 6191 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)F 22a_100020588587_100000198493 [0,2,0,0,0,0|2,0,0]=4 6192 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)I 22a_100020588587_100011217499 [0,2,0,0,0,0|2,0,0]=4 6193 B16R1.51 C=CCNNC(=O)CCc1ccc(cc1)O 22a_100020588587_100000742835 [0,2,0,0,0,0|2,0,0]=4 6194 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)Br 22a_100020588587_100000182358 [0,2,0,0,0,0|1,0,0]=3 6195 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)C 22a_100020588587_100000182360 [0,2,0,0,0,0|1,0,0]=3 6196 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)Cl 22a_100020588587_100016990877 [0,2,0,0,0,0|1,0,0]=3 6197 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)F 22a_100020588587_100000184765 [0,2,0,0,0,0|1,0,0]=3 6198 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)I 22a_100020588587_100000184369 [0,2,0,0,0,0|1,0,0]=3 6199 B16R1.51 C=CCNNC(=O)COc1ccc(cc1)O 22a_100020588587_100000031633 [0,2,0,0,0,0|1,0,0]=3 6200 B16R1.51 C=CCNNC(=O)CSc1ccc(cc1)Br 22a_100020588587_100000179496 [0,2,0,0,0,0|1,1,0]=4 6201 B16R1.51 C=CCNNC(=O)CSc1ccc(cc1)C 22a_100020588587_100000179497 [0,2,0,0,0,0|1,1,0]=4 6202 B16R1.51 C=CCNNC(=O)CSc1ccc(cc1)Cl 22a_100020588587_100000178402 [0,2,0,0,0,0|1,1,0]=4 6203 B16R1.51 C=CCNNC(=O)CSc1ccc(cc1)F 22a_100020588587_100000691584 [0,2,0,0,0,0|1,1,0]=4 6204 B16R1.51 C=CCOCC(=O)NCc1ccc(cc1)C 34a_200000210373_100000183211 [0,2,0,0,0,0|2,0,0]=4 6205 B16R1.51 C=CCOCC(=O)NCc1ccc(cc1)Cl 34a_200000210373_100000183476 [0,2,0,0,0,0|2,0,0]=4 6206 B16R1.51 C=CCOCC(=O)NCc1ccc(cc1)F 34a_200000210373_100000182461 [0,2,0,0,0,0|2,0,0]=4 6207 B16R1.51 C=CCSCC(=O)CCc1ccc(cc1)Br 1458a_100000230395_100011740612 [0,2,0,0,0,0|1,1,0]=4 6208 B16R1.51 C=CCSCC(=O)CCc1ccc(cc1)C 1458a_100000230395_100011713686 [0,2,0,0,0,0|1,1,0]=4 6209 B16R1.51 C=CCSCC(=O)CCc1ccc(cc1)Cl 1458a_100000230395_100011713675 [0,2,0,0,0,0|1,1,0]=4 6210 B16R1.51 C=CCSCC(=O)CCc1ccc(cc1)F 1458a_100000230395_100011217392 [0,2,0,0,0,0|1,1,0]=4 6211 B16R1.51 C=CCSCC(=O)CCc1ccc(cc1)O 1458a_100000230395_100009816426 [0,2,0,0,0,0|1,1,0]=4 6212 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000039644 [0,2,0,0,0,0|2,0,0]=4 6213 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000039644 [0,2,0,0,0,0|2,0,0]=4 6214 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000039644 [0,2,0,0,0,0|2,0,0]=4 6215 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000039644 [0,2,0,0,0,0|2,0,0]=4 6216 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000039644 [0,2,0,0,0,0|2,0,0]=4 6217 B16R1.51 C=COCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000039644 [0,2,0,0,0,0|2,0,0]=4 6218 B16R1.51 C=COCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000039644 [0,2,0,0,0,0|1,0,0]=3 6219 B16R1.51 C=COCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000039644 [0,2,0,0,0,0|1,0,0]=3 6220 B16R1.51 C=COCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000039644 [0,2,0,0,0,0|1,0,0]=3 6221 B16R1.51 C=COCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000039644 [0,2,0,0,0,0|1,0,0]=3 6222 B16R1.51 C=COCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000039644 [0,2,0,0,0,0|1,0,0]=3 6223 B16R1.51 C=COCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000039644 [0,2,0,0,0,0|1,0,0]=3 6224 B16R1.51 C=COCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000039644 [0,2,0,0,0,0|1,1,0]=4 6225 B16R1.51 C=COCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000039644 [0,2,0,0,0,0|1,1,0]=4 6226 B16R1.51 C=COCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000039644 [0,2,0,0,0,0|1,1,0]=4 6227 B16R1.51 C=COCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000039644 [0,2,0,0,0,0|1,1,0]=4 6228 B16R1.51 CC=CCOC(C)COc1ccc(cc1)C 34a_100011217472_100000070051 [0,2,0,0,0,0|1,0,1]=4 6229 B16R1.51 CC=CCOC(C)COc1ccc(cc1)C 7a_100011217472_100000070051 [0,2,0,0,0,0|1,0,1]=4 6230 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Br 34a_100000185759_100000211628 [0,2,0,0,0,0|0,0,2]=4 6231 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Br 7a_100000185759_100000211628 [0,2,0,0,0,0|0,0,2]=4 6232 B16R1.51 CCCCOC(=O)COc1ccc(cc1)C 34a_100000210336_100000211628 [0,2,0,0,0,0|0,0,2]=4 6233 B16R1.51 CCCCOC(=O)COc1ccc(cc1)C 7a_100000210336_100000211628 [0,2,0,0,0,0|0,0,2]=4 6234 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000211628 [0,2,0,0,0,0|0,0,2]=4 6235 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000211628 [0,2,0,0,0,0|0,0,2]=4 6236 B16R1.51 CCCCOC(=O)COc1ccc(cc1)F 34a_100000210339_100000211628 [0,2,0,0,0,0|0,0,2]=4 6237 B16R1.51 CCCCOC(=O)COc1ccc(cc1)I 34a_100000212066_100000211628 [0,2,0,0,0,0|0,0,2]=4 6238 B16R1.51 CCCCOC(=O)COc1ccc(cc1)I 7a_100000212066_100000211628 [0,2,0,0,0,0|0,0,2]=4 6239 B16R1.51 CCCCOC(=O)COc1ccc(cc1)N 34a_100000185829_100000211628 [0,2,0,0,0,0|0,0,2]=4 6240 B16R1.51 COCCOC(=O)COc1ccc(cc1)Br 34a_100000185759_200000040189 [0,2,0,0,0,0|0,0,2]=4 6241 B16R1.51 COCCOC(=O)COc1ccc(cc1)Br 7a_100000185759_200000040189 [0,2,0,0,0,0|0,0,2]=4 6242 B16R1.51 COCCOC(=O)COc1ccc(cc1)C 34a_100000210336_200000040189 [0,2,0,0,0,0|0,0,2]=4 6243 B16R1.51 COCCOC(=O)COc1ccc(cc1)C 7a_100000210336_200000040189 [0,2,0,0,0,0|0,0,2]=4 6244 B16R1.51 COCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_200000040189 [0,2,0,0,0,0|0,0,2]=4 6245 B16R1.51 COCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_200000040189 [0,2,0,0,0,0|0,0,2]=4 6246 B16R1.51 COCCOC(=O)COc1ccc(cc1)F 34a_100000210339_200000040189 [0,2,0,0,0,0|0,0,2]=4 6247 B16R1.51 COCCOC(=O)COc1ccc(cc1)I 34a_100000212066_200000040189 [0,2,0,0,0,0|0,0,2]=4 6248 B16R1.51 COCCOC(=O)COc1ccc(cc1)I 7a_100000212066_200000040189 [0,2,0,0,0,0|0,0,2]=4 6249 B16R1.51 COCCOC(=O)COc1ccc(cc1)N 34a_100000185829_200000040189 [0,2,0,0,0,0|0,0,2]=4 6250 B16R1.52 C/C=C/COC(C)COc1cccc(c1)C 34a_200011219432_100102629194 [0,2,0,0,0,0|1,0,1]=4 6251 B16R1.52 C/C=C/COC(C)COc1cccc(c1)C 7a_200011219432_100102629194 [0,2,0,0,0,0|1,0,1]=4 6252 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000757094 [0,2,0,0,0,0|2,0,0]=4 6253 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)Br 1458a_100000766728_100011740638 [0,2,0,0,0,0|2,0,0]=4 6254 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000757094 [0,2,0,0,0,0|2,0,0]=4 6255 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)C 1458a_100000766728_100011713685 [0,2,0,0,0,0|2,0,0]=4 6256 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000757094 [0,2,0,0,0,0|2,0,0]=4 6257 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)Cl 1458a_100000766728_100011713710 [0,2,0,0,0,0|2,0,0]=4 6258 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000757094 [0,2,0,0,0,0|2,0,0]=4 6259 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)F 1458a_100000766728_100011217235 [0,2,0,0,0,0|2,0,0]=4 6260 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000757094 [0,2,0,0,0,0|2,0,0]=4 6261 B16R1.52 C=CCCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000757094 [0,2,0,0,0,0|2,0,0]=4 6262 B16R1.52 C=CCCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000757094 [0,2,0,0,0,0|1,0,0]=3 6263 B16R1.52 C=CCCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000757094 [0,2,0,0,0,0|1,0,0]=3 6264 B16R1.52 C=CCCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000757094 [0,2,0,0,0,0|1,0,0]=3 6265 B16R1.52 C=CCCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000757094 [0,2,0,0,0,0|1,0,0]=3 6266 B16R1.52 C=CCCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000757094 [0,2,0,0,0,0|1,1,0]=4 6267 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Br 11a_100015191253_100000184314 [0,2,0,0,0,0|2,0,0]=4 6268 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Br 1626a_100015191253_100000184314 [0,2,0,0,0,0|2,0,0]=4 6269 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Br 240690a_100015191253_100000184314 [0,2,0,0,0,0|2,0,0]=4 6270 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Br 527a_100015191253_100000184314 [0,2,0,0,0,0|2,0,0]=4 6271 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)C 11a_100015191253_100000234952 [0,2,0,0,0,0|2,0,0]=4 6272 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)C 1626a_100015191253_100000234952 [0,2,0,0,0,0|2,0,0]=4 6273 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)C 240690a_100015191253_100000234952 [0,2,0,0,0,0|2,0,0]=4 6274 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)C 527a_100015191253_100000234952 [0,2,0,0,0,0|2,0,0]=4 6275 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Cl 11a_100015191253_100000235675 [0,2,0,0,0,0|2,0,0]=4 6276 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Cl 1626a_100015191253_100000235675 [0,2,0,0,0,0|2,0,0]=4 6277 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Cl 240690a_100015191253_100000235675 [0,2,0,0,0,0|2,0,0]=4 6278 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)Cl 527a_100015191253_100000235675 [0,2,0,0,0,0|2,0,0]=4 6279 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)F 11a_100015191253_100000235673 [0,2,0,0,0,0|2,0,0]=4 6280 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)F 1626a_100015191253_100000235673 [0,2,0,0,0,0|2,0,0]=4 6281 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)F 240690a_100015191253_100000235673 [0,2,0,0,0,0|2,0,0]=4 6282 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)F 527a_100015191253_100000235673 [0,2,0,0,0,0|2,0,0]=4 6283 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)I 11a_100015191253_100010007846 [0,2,0,0,0,0|2,0,0]=4 6284 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)I 1626a_100015191253_100010007846 [0,2,0,0,0,0|2,0,0]=4 6285 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)I 240690a_100015191253_100010007846 [0,2,0,0,0,0|2,0,0]=4 6286 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)I 527a_100015191253_100010007846 [0,2,0,0,0,0|2,0,0]=4 6287 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)O 240690a_100015191253_100011216126 [0,2,0,0,0,0|2,0,0]=4 6288 B16R1.52 C=CCCNC(=O)CCc1cccc(c1)O 527a_100015191253_100011216126 [0,2,0,0,0,0|2,0,0]=4 6289 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Br 11a_100015191253_100000182359 [0,2,0,0,0,0|1,0,0]=3 6290 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Br 1626a_100015191253_100000182359 [0,2,0,0,0,0|1,0,0]=3 6291 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Br 240690a_100015191253_100000182359 [0,2,0,0,0,0|1,0,0]=3 6292 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Br 527a_100015191253_100000182359 [0,2,0,0,0,0|1,0,0]=3 6293 B16R1.52 C=CCCNC(=O)COc1cccc(c1)C 11a_100015191253_100000183606 [0,2,0,0,0,0|1,0,0]=3 6294 B16R1.52 C=CCCNC(=O)COc1cccc(c1)C 1626a_100015191253_100000183606 [0,2,0,0,0,0|1,0,0]=3 6295 B16R1.52 C=CCCNC(=O)COc1cccc(c1)C 240690a_100015191253_100000183606 [0,2,0,0,0,0|1,0,0]=3 6296 B16R1.52 C=CCCNC(=O)COc1cccc(c1)C 527a_100015191253_100000183606 [0,2,0,0,0,0|1,0,0]=3 6297 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Cl 11a_100015191253_100000184978 [0,2,0,0,0,0|1,0,0]=3 6298 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Cl 1626a_100015191253_100000184978 [0,2,0,0,0,0|1,0,0]=3 6299 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Cl 240690a_100015191253_100000184978 [0,2,0,0,0,0|1,0,0]=3 6300 B16R1.52 C=CCCNC(=O)COc1cccc(c1)Cl 527a_100015191253_100000184978 [0,2,0,0,0,0|1,0,0]=3 6301 B16R1.52 C=CCCNC(=O)COc1cccc(c1)F 11a_100015191253_100000182781 [0,2,0,0,0,0|1,0,0]=3 6302 B16R1.52 C=CCCNC(=O)COc1cccc(c1)F 1626a_100015191253_100000182781 [0,2,0,0,0,0|1,0,0]=3 6303 B16R1.52 C=CCCNC(=O)COc1cccc(c1)F 240690a_100015191253_100000182781 [0,2,0,0,0,0|1,0,0]=3 6304 B16R1.52 C=CCCNC(=O)COc1cccc(c1)F 527a_100015191253_100000182781 [0,2,0,0,0,0|1,0,0]=3 6305 B16R1.52 C=CCCNC(=O)CSc1cccc(c1)Br 11a_100015191253_100000760868 [0,2,0,0,0,0|1,1,0]=4 6306 B16R1.52 C=CCCNC(=O)CSc1cccc(c1)Br 1626a_100015191253_100000760868 [0,2,0,0,0,0|1,1,0]=4 6307 B16R1.52 C=CCCNC(=O)CSc1cccc(c1)Br 240690a_100015191253_100000760868 [0,2,0,0,0,0|1,1,0]=4 6308 B16R1.52 C=CCCNC(=O)CSc1cccc(c1)Br 527a_100015191253_100000760868 [0,2,0,0,0,0|1,1,0]=4 6309 B16R1.52 C=CCCOC(C)COc1cccc(c1)C 34a_200011219432_100000754431 [0,2,0,0,0,0|1,0,1]=4 6310 B16R1.52 C=CCCOC(C)COc1cccc(c1)C 7a_200011219432_100000754431 [0,2,0,0,0,0|1,0,1]=4 6311 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)Br 22a_100020588587_100000184314 [0,2,0,0,0,0|2,0,0]=4 6312 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)C 22a_100020588587_100000234952 [0,2,0,0,0,0|2,0,0]=4 6313 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)Cl 22a_100020588587_100000235675 [0,2,0,0,0,0|2,0,0]=4 6314 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)F 22a_100020588587_100000235673 [0,2,0,0,0,0|2,0,0]=4 6315 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)I 22a_100020588587_100010007846 [0,2,0,0,0,0|2,0,0]=4 6316 B16R1.52 C=CCNNC(=O)CCc1cccc(c1)O 22a_100020588587_100011216126 [0,2,0,0,0,0|2,0,0]=4 6317 B16R1.52 C=CCNNC(=O)COc1cccc(c1)Br 22a_100020588587_100000182359 [0,2,0,0,0,0|1,0,0]=3 6318 B16R1.52 C=CCNNC(=O)COc1cccc(c1)C 22a_100020588587_100000183606 [0,2,0,0,0,0|1,0,0]=3 6319 B16R1.52 C=CCNNC(=O)COc1cccc(c1)Cl 22a_100020588587_100000184978 [0,2,0,0,0,0|1,0,0]=3 6320 B16R1.52 C=CCNNC(=O)COc1cccc(c1)F 22a_100020588587_100000182781 [0,2,0,0,0,0|1,0,0]=3 6321 B16R1.52 C=CCNNC(=O)CSc1cccc(c1)Br 22a_100020588587_100000760868 [0,2,0,0,0,0|1,1,0]=4 6322 B16R1.52 C=CCOCC(=O)NCc1cccc(c1)Br 34a_200000210373_100011263252 [0,2,0,0,0,0|2,0,0]=4 6323 B16R1.52 C=CCOCC(=O)NCc1cccc(c1)C 34a_200000210373_100000754571 [0,2,0,0,0,0|2,0,0]=4 6324 B16R1.52 C=CCOCC(=O)NCc1cccc(c1)Cl 34a_200000210373_100000181154 [0,2,0,0,0,0|2,0,0]=4 6325 B16R1.52 C=CCOCC(=O)NCc1cccc(c1)F 34a_200000210373_100000738998 [0,2,0,0,0,0|2,0,0]=4 6326 B16R1.52 C=CCSCC(=O)CCc1cccc(c1)Br 1458a_100000230395_100011740638 [0,2,0,0,0,0|1,1,0]=4 6327 B16R1.52 C=CCSCC(=O)CCc1cccc(c1)C 1458a_100000230395_100011713685 [0,2,0,0,0,0|1,1,0]=4 6328 B16R1.52 C=CCSCC(=O)CCc1cccc(c1)Cl 1458a_100000230395_100011713710 [0,2,0,0,0,0|1,1,0]=4 6329 B16R1.52 C=CCSCC(=O)CCc1cccc(c1)F 1458a_100000230395_100011217235 [0,2,0,0,0,0|1,1,0]=4 6330 B16R1.52 C=COCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000039644 [0,2,0,0,0,0|2,0,0]=4 6331 B16R1.52 C=COCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000039644 [0,2,0,0,0,0|2,0,0]=4 6332 B16R1.52 C=COCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000039644 [0,2,0,0,0,0|2,0,0]=4 6333 B16R1.52 C=COCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000039644 [0,2,0,0,0,0|2,0,0]=4 6334 B16R1.52 C=COCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000039644 [0,2,0,0,0,0|2,0,0]=4 6335 B16R1.52 C=COCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000039644 [0,2,0,0,0,0|2,0,0]=4 6336 B16R1.52 C=COCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000039644 [0,2,0,0,0,0|1,0,0]=3 6337 B16R1.52 C=COCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000039644 [0,2,0,0,0,0|1,0,0]=3 6338 B16R1.52 C=COCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000039644 [0,2,0,0,0,0|1,0,0]=3 6339 B16R1.52 C=COCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000039644 [0,2,0,0,0,0|1,0,0]=3 6340 B16R1.52 C=COCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000039644 [0,2,0,0,0,0|1,1,0]=4 6341 B16R1.52 CC=CCOC(C)COc1cccc(c1)C 34a_200011219432_100000070051 [0,2,0,0,0,0|1,0,1]=4 6342 B16R1.52 CC=CCOC(C)COc1cccc(c1)C 7a_200011219432_100000070051 [0,2,0,0,0,0|1,0,1]=4 6343 B16R1.52 CCCCOC(=O)COc1cccc(c1)Br 34a_100000210342_100000211628 [0,2,0,0,0,0|0,0,2]=4 6344 B16R1.52 CCCCOC(=O)COc1cccc(c1)Br 7a_100000210342_100000211628 [0,2,0,0,0,0|0,0,2]=4 6345 B16R1.52 CCCCOC(=O)COc1cccc(c1)C 34a_100000210337_100000211628 [0,2,0,0,0,0|0,0,2]=4 6346 B16R1.52 CCCCOC(=O)COc1cccc(c1)C 7a_100000210337_100000211628 [0,2,0,0,0,0|0,0,2]=4 6347 B16R1.52 CCCCOC(=O)COc1cccc(c1)Cl 34a_100000210295_100000211628 [0,2,0,0,0,0|0,0,2]=4 6348 B16R1.52 CCCCOC(=O)COc1cccc(c1)Cl 7a_100000210295_100000211628 [0,2,0,0,0,0|0,0,2]=4 6349 B16R1.52 CCCCOC(=O)COc1cccc(c1)F 34a_100000210426_100000211628 [0,2,0,0,0,0|0,0,2]=4 6350 B16R1.52 CCCCOC(=O)COc1cccc(c1)F 7a_100000210426_100000211628 [0,2,0,0,0,0|0,0,2]=4 6351 B16R1.52 CCCCOC(=O)COc1cccc(c1)I 34a_100000211634_100000211628 [0,2,0,0,0,0|0,0,2]=4 6352 B16R1.52 CCCCOC(=O)COc1cccc(c1)I 7a_100000211634_100000211628 [0,2,0,0,0,0|0,0,2]=4 6353 B16R1.52 CCCCOC(=O)COc1cccc(c1)N 34a_100000210217_100000211628 [0,2,0,0,0,0|0,0,2]=4 6354 B16R1.52 COCCOC(=O)COc1cccc(c1)Br 34a_100000210342_200000040189 [0,2,0,0,0,0|0,0,2]=4 6355 B16R1.52 COCCOC(=O)COc1cccc(c1)Br 7a_100000210342_200000040189 [0,2,0,0,0,0|0,0,2]=4 6356 B16R1.52 COCCOC(=O)COc1cccc(c1)C 34a_100000210337_200000040189 [0,2,0,0,0,0|0,0,2]=4 6357 B16R1.52 COCCOC(=O)COc1cccc(c1)C 7a_100000210337_200000040189 [0,2,0,0,0,0|0,0,2]=4 6358 B16R1.52 COCCOC(=O)COc1cccc(c1)Cl 34a_100000210295_200000040189 [0,2,0,0,0,0|0,0,2]=4 6359 B16R1.52 COCCOC(=O)COc1cccc(c1)Cl 7a_100000210295_200000040189 [0,2,0,0,0,0|0,0,2]=4 6360 B16R1.52 COCCOC(=O)COc1cccc(c1)F 34a_100000210426_200000040189 [0,2,0,0,0,0|0,0,2]=4 6361 B16R1.52 COCCOC(=O)COc1cccc(c1)F 7a_100000210426_200000040189 [0,2,0,0,0,0|0,0,2]=4 6362 B16R1.52 COCCOC(=O)COc1cccc(c1)I 34a_100000211634_200000040189 [0,2,0,0,0,0|0,0,2]=4 6363 B16R1.52 COCCOC(=O)COc1cccc(c1)I 7a_100000211634_200000040189 [0,2,0,0,0,0|0,0,2]=4 6364 B16R1.52 COCCOC(=O)COc1cccc(c1)N 34a_100000210217_200000040189 [0,2,0,0,0,0|0,0,2]=4 6365 B16R1.608 C=C(C)C=NNC(=O)COc1ccccc1 4a_100000186219_100000210575 [0,2,0,0,0,0|1,0,1]=4 6366 B16R1.608 C=C(C)CCOC(C)COc1ccccc1 34a_100000210911_100000730704 [0,2,0,0,0,0|1,0,1]=4 6367 B16R1.608 C=C(C)CCOC(C)COc1ccccc1 7a_100000210911_100000730704 [0,2,0,0,0,0|1,0,1]=4 6368 B16R1.608 C=C(C)CNNC(=O)CCc1ccccc1 22a_100000729518_100000185753 [0,2,0,0,0,0|2,0,0]=4 6369 B16R1.608 C=C(C)CNNC(=O)COc1ccccc1 22a_100000729518_100000186222 [0,2,0,0,0,0|1,0,0]=3 6370 B16R1.608 C=C(C)CNNC(=O)COc1ccccn1 22a_100000729518_100102699861 [0,2,0,0,0,0|2,0,0]=4 6371 B16R1.608 C=C(C)CNNC(=O)COc1cccnc1 22a_100000729518_100015207166 [0,2,0,0,0,0|2,0,0]=4 6372 B16R1.608 C=C(C)CNNC(=O)CSc1ccccc1 22a_100000729518_100000211596 [0,2,0,0,0,0|1,1,0]=4 6373 B16R1.608 C=C(C)COCC(=O)CCc1ccccc1 34a_100000210245_100012361361 [0,2,0,0,0,0|1,0,0]=3 6374 B16R1.608 C=C(C)COCC(=O)NCc1ccccc1 34a_100000210245_100000183539 [0,2,0,0,0,0|2,0,0]=4 6375 B16R1.608 C=C(C)COCC(=O)OCc1ccccc1 34a_100000210245_100000753625 [0,2,0,0,0,0|2,0,0]=4 6376 B16R1.608 C=C(C)CSCC(=O)CCc1ccccc1 62a_100000748629_100012361361 [0,2,0,0,0,0|1,1,0]=4 6377 B16R1.608 C=C(C)CSCC(=O)CCc1ccccc1 62a_100012361361_100000211660 [0,2,0,0,0,0|1,1,0]=4 6378 B16R1.608 C=C(F)COCC(=O)CCc1ccccc1 34a_200010262243_100012361361 [0,2,0,0,0,0|1,0,0]=3 6379 B16R1.608 C=C(F)COCC(=O)NCc1ccccc1 34a_200010262243_100000183539 [0,2,0,0,0,0|2,0,0]=4 6380 B16R1.608 C=C(F)COCC(=O)OCc1ccccc1 34a_200010262243_100000753625 [0,2,0,0,0,0|2,0,0]=4 6381 B16R1.608 C=C(F)CSCC(=O)CCc1ccccc1 62a_100000042424_100012361361 [0,2,0,0,0,0|1,1,0]=4 6382 B16R1.608 C=C(F)CSCC(=O)CCc1ccccc1 62a_100012361361_100000042424 [0,2,0,0,0,0|1,1,0]=4 6383 B16R1.608 CC(=CCCC(=O)CCc1ccccc1)C 1458a_100000185753_100011217483 [0,2,0,0,0,0|2,0,0]=4 6384 B16R1.608 CC(=CCCC(=O)COc1ccccc1)C 1458a_100000186222_100011217483 [0,2,0,0,0,0|1,0,0]=3 6385 B16R1.608 CC(=CCCC(=O)COc1ccccn1)C 1458a_100102699861_100011217483 [0,2,0,0,0,0|2,0,0]=4 6386 B16R1.608 CC(=CCCC(=O)COc1cccnc1)C 1458a_100015207166_100011217483 [0,2,0,0,0,0|2,0,0]=4 6387 B16R1.608 CC(=CCCC(=O)CSc1ccccc1)C 1458a_100000211596_100011217483 [0,2,0,0,0,0|1,1,0]=4 6388 B16R1.608 CC(=CCNC(=O)CCc1ccccc1)C 11a_100000718196_100000185753 [0,2,0,0,0,0|2,0,0]=4 6389 B16R1.608 CC(=CCNC(=O)CCc1ccccc1)C 1626a_100000718196_100000185753 [0,2,0,0,0,0|2,0,0]=4 6390 B16R1.608 CC(=CCNC(=O)CCc1ccccc1)C 527a_100000718196_100000185753 [0,2,0,0,0,0|2,0,0]=4 6391 B16R1.608 CC(=CCNC(=O)COc1ccccc1)C 11a_100000718196_100000186222 [0,2,0,0,0,0|1,0,0]=3 6392 B16R1.608 CC(=CCNC(=O)COc1ccccc1)C 1626a_100000718196_100000186222 [0,2,0,0,0,0|1,0,0]=3 6393 B16R1.608 CC(=CCNC(=O)COc1ccccc1)C 527a_100000718196_100000186222 [0,2,0,0,0,0|1,0,0]=3 6394 B16R1.608 CC(=CCNC(=O)COc1ccccn1)C 1626a_100000718196_100102699861 [0,2,0,0,0,0|2,0,0]=4 6395 B16R1.608 CC(=CCNC(=O)COc1ccccn1)C 527a_100000718196_100102699861 [0,2,0,0,0,0|2,0,0]=4 6396 B16R1.608 CC(=CCNC(=O)COc1cccnc1)C 11a_100000718196_100015207166 [0,2,0,0,0,0|2,0,0]=4 6397 B16R1.608 CC(=CCNC(=O)COc1cccnc1)C 1626a_100000718196_100015207166 [0,2,0,0,0,0|2,0,0]=4 6398 B16R1.608 CC(=CCNC(=O)COc1cccnc1)C 527a_100000718196_100015207166 [0,2,0,0,0,0|2,0,0]=4 6399 B16R1.608 CC(=CCNC(=O)CSc1ccccc1)C 11a_100000718196_100000211596 [0,2,0,0,0,0|1,1,0]=4 6400 B16R1.608 CC(=CCNC(=O)CSc1ccccc1)C 1626a_100000718196_100000211596 [0,2,0,0,0,0|1,1,0]=4 6401 B16R1.608 CC(=CCNC(=O)CSc1ccccc1)C 527a_100000718196_100000211596 [0,2,0,0,0,0|1,1,0]=4 6402 B16R1.608 CC(=CCOC(C)COc1ccccc1)C 34a_100000210911_100000761012 [0,2,0,0,0,0|1,0,1]=4 6403 B16R1.608 CC(=CCOC(C)COc1ccccc1)C 7a_100000210911_100000761012 [0,2,0,0,0,0|1,0,1]=4 6404 B16R1.608 CC(=O)CCCC(=O)COc1ccccc1 1458a_100000186222_100011215641 [0,2,0,0,0,0|1,0,1]=4 6405 B16R1.608 CC(=O)COCC(=O)CCc1ccccc1 34a_100000211253_100012361361 [0,2,0,0,0,0|1,0,1]=4 6406 B16R1.608 CC(=O)NCCC(=O)COc1ccccc1 1458a_100000186222_100000189650 [0,2,0,0,0,0|1,0,1]=4 6407 B16R1.608 CC(=O)OCCC(=O)COc1ccccc1 1458a_100000186222_100009814007 [0,2,0,0,0,0|1,0,1]=4 6408 B16R1.608 NC(=O)CCCC(=O)COc1ccccc1 1458a_100000186222_100102525003 [0,2,0,0,0,0|1,0,1]=4 6409 B16R1.608 NC(=O)CCNC(=O)COc1ccccc1 11a_100000740010_100000186222 [0,2,0,0,0,0|1,0,1]=4 6410 B16R1.608 NC(=O)CCNC(=O)COc1ccccc1 240690a_100000740010_100000186222 [0,2,0,0,0,0|1,0,1]=4 6411 B16R1.608 NC(=O)CCNC(=O)COc1ccccc1 527a_100000740010_100000186222 [0,2,0,0,0,0|1,0,1]=4 6412 B16R1.608 NC(=O)COCC(=O)CCc1ccccc1 1458a_100011219004_100000765856 [0,2,0,0,0,0|2,0,0]=4 6413 B16R1.608 NC(=O)NCCC(=O)COc1ccccc1 1458a_100000186222_200000034859 [0,2,0,0,0,0|2,0,0]=4 6414 B16R1.608 NC(=O)OCCC(=O)COc1ccccc1 1458a_100000186222_200011214921 [0,2,0,0,0,0|2,0,0]=4 6415 B16R1.608 O=C(CCC=C(F)F)CCc1ccccc1 1458a_100000185753_200009816681 [0,2,0,0,0,0|2,0,0]=4 6416 B16R1.608 O=C(CCC=C(F)F)COc1ccccc1 1458a_100000186222_200009816681 [0,2,0,0,0,0|1,0,0]=3 6417 B16R1.608 O=C(CCC=C(F)F)COc1ccccn1 1458a_100102699861_200009816681 [0,2,0,0,0,0|2,0,0]=4 6418 B16R1.608 O=C(CCC=C(F)F)COc1cccnc1 1458a_100015207166_200009816681 [0,2,0,0,0,0|2,0,0]=4 6419 B16R1.608 O=C(CCC=C(F)F)CSc1ccccc1 1458a_100000211596_200009816681 [0,2,0,0,0,0|1,1,0]=4 6420 B16R1.688 C#CCOCCC(=O)COc1ccccc1 1458a_100000186222_100010402529 [0,2,0,0,0,0|0,0,2]=4 6421 B16R1.688 C/C=C/COCC(=O)CCc1ccccc1 34a_100016270725_100012361361 [0,2,0,0,0,0|1,0,0]=3 6422 B16R1.688 C/C=C/COCC(=O)NCc1ccccc1 34a_100016270725_100000183539 [0,2,0,0,0,0|2,0,0]=4 6423 B16R1.688 C/C=C/COCC(=O)OCc1ccccc1 34a_100016270725_100000753625 [0,2,0,0,0,0|2,0,0]=4 6424 B16R1.688 C/C=C/CSCC(=O)CCc1ccccc1 62a_100012361361_100102629194 [0,2,0,0,0,0|1,1,0]=4 6425 B16R1.688 C/C=C/CSCC(=O)CCc1ccccc1 62a_100102629194_100012361361 [0,2,0,0,0,0|1,1,0]=4 6426 B16R1.688 C=CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100011215482 [0,2,0,0,0,0|2,0,0]=4 6427 B16R1.688 C=CCCCCC(=O)CCc1ccccc1 1458a_100011215552_100000765856 [0,2,0,0,0,0|2,0,0]=4 6428 B16R1.688 C=CCCCCC(=O)COc1ccccc1 1458a_100000186222_100011215482 [0,2,0,0,0,0|1,0,0]=3 6429 B16R1.688 C=CCCCCC(=O)COc1ccccn1 1458a_100102699861_100011215482 [0,2,0,0,0,0|2,0,0]=4 6430 B16R1.688 C=CCCCCC(=O)COc1cccnc1 1458a_100015207166_100011215482 [0,2,0,0,0,0|2,0,0]=4 6431 B16R1.688 C=CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100011215482 [0,2,0,0,0,0|1,1,0]=4 6432 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 11a_100000700776_100000185753 [0,2,0,0,0,0|2,0,0]=4 6433 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 1626a_100000700776_100000185753 [0,2,0,0,0,0|2,0,0]=4 6434 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 240690a_100000700776_100000185753 [0,2,0,0,0,0|2,0,0]=4 6435 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 527a_100000700776_100000185753 [0,2,0,0,0,0|2,0,0]=4 6436 B16R1.688 C=CCCCNC(=O)COc1ccccc1 11a_100000700776_100000186222 [0,2,0,0,0,0|1,0,0]=3 6437 B16R1.688 C=CCCCNC(=O)COc1ccccc1 1626a_100000700776_100000186222 [0,2,0,0,0,0|1,0,0]=3 6438 B16R1.688 C=CCCCNC(=O)COc1ccccc1 240690a_100000700776_100000186222 [0,2,0,0,0,0|1,0,0]=3 6439 B16R1.688 C=CCCCNC(=O)COc1ccccc1 527a_100000700776_100000186222 [0,2,0,0,0,0|1,0,0]=3 6440 B16R1.688 C=CCCCNC(=O)COc1ccccn1 1626a_100000700776_100102699861 [0,2,0,0,0,0|2,0,0]=4 6441 B16R1.688 C=CCCCNC(=O)COc1ccccn1 240690a_100000700776_100102699861 [0,2,0,0,0,0|2,0,0]=4 6442 B16R1.688 C=CCCCNC(=O)COc1ccccn1 527a_100000700776_100102699861 [0,2,0,0,0,0|2,0,0]=4 6443 B16R1.688 C=CCCCNC(=O)COc1cccnc1 11a_100000700776_100015207166 [0,2,0,0,0,0|2,0,0]=4 6444 B16R1.688 C=CCCCNC(=O)COc1cccnc1 1626a_100000700776_100015207166 [0,2,0,0,0,0|2,0,0]=4 6445 B16R1.688 C=CCCCNC(=O)COc1cccnc1 240690a_100000700776_100015207166 [0,2,0,0,0,0|2,0,0]=4 6446 B16R1.688 C=CCCCNC(=O)COc1cccnc1 527a_100000700776_100015207166 [0,2,0,0,0,0|2,0,0]=4 6447 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 11a_100000700776_100000211596 [0,2,0,0,0,0|1,1,0]=4 6448 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 1626a_100000700776_100000211596 [0,2,0,0,0,0|1,1,0]=4 6449 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 240690a_100000700776_100000211596 [0,2,0,0,0,0|1,1,0]=4 6450 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 527a_100000700776_100000211596 [0,2,0,0,0,0|1,1,0]=4 6451 B16R1.688 C=CCCCOC(C)COc1ccccc1 34a_100000210911_100000757094 [0,2,0,0,0,0|1,0,1]=4 6452 B16R1.688 C=CCCCOC(C)COc1ccccc1 7a_100000210911_100000757094 [0,2,0,0,0,0|1,0,1]=4 6453 B16R1.688 C=CCCNCC(=O)CCc1ccccc1 2230a_100015191253_100012361361 [0,2,0,0,0,0|2,0,0]=4 6454 B16R1.688 C=CCCOCC(=O)CCc1ccccc1 34a_100011205117_100012361361 [0,2,0,0,0,0|1,0,0]=3 6455 B16R1.688 C=CCCOCC(=O)NCc1ccccc1 34a_100011205117_100000183539 [0,2,0,0,0,0|2,0,0]=4 6456 B16R1.688 C=CCCOCC(=O)OCc1ccccc1 34a_100011205117_100000753625 [0,2,0,0,0,0|2,0,0]=4 6457 B16R1.688 C=CCCSCC(=O)CCc1ccccc1 62a_100000754431_100012361361 [0,2,0,0,0,0|1,1,0]=4 6458 B16R1.688 C=CCCSCC(=O)CCc1ccccc1 62a_100012361361_100000754431 [0,2,0,0,0,0|1,1,0]=4 6459 B16R1.688 C=CCOCCC(=O)CCc1ccccc1 1458a_200011217002_100000765856 [0,2,0,0,0,0|1,0,0]=3 6460 B16R1.688 C=CCOCCC(=O)CCc1ccccn1 1458a_200011217002_100015183660 [0,2,0,0,0,0|2,0,0]=4 6461 B16R1.688 C=CCOCCC(=O)CCc1cccnc1 1458a_200011217002_200011713674 [0,2,0,0,0,0|2,0,0]=4 6462 B16R1.688 C=CCOCCC(=O)CCc1ccncc1 1458a_200011217002_100000723409 [0,2,0,0,0,0|2,0,0]=4 6463 B16R1.688 C=CCOCCC(=O)NCc1ccccc1 11a_100015324214_200011217002 [0,2,0,0,0,0|2,0,0]=4 6464 B16R1.688 C=CCOCCC(=O)NCc1ccccc1 1626a_100015324214_200011217002 [0,2,0,0,0,0|2,0,0]=4 6465 B16R1.688 C=CCOCCC(=O)NCc1ccccc1 240690a_100015324214_200011217002 [0,2,0,0,0,0|2,0,0]=4 6466 B16R1.688 C=CCOCCC(=O)NCc1ccccc1 527a_100015324214_200011217002 [0,2,0,0,0,0|2,0,0]=4 6467 B16R1.688 C=CCOCCC(=O)NNc1ccccc1 22a_100015195140_200011217002 [0,2,0,0,0,0|2,0,0]=4 6468 B16R1.688 C=CCOCCC(=O)OCc1ccccc1 7a_100009831632_100015514636 [0,2,0,0,0,0|2,0,0]=4 6469 B16R1.688 C=COCCOC(C)COc1ccccc1 34a_100000210911_100000039644 [0,2,0,0,0,0|1,0,1]=4 6470 B16R1.688 C=COCCOC(C)COc1ccccc1 7a_100000210911_100000039644 [0,2,0,0,0,0|1,0,1]=4 6471 B16R1.688 CC/C=C\CCC(=O)CCc1ccccc1 1458a_100000185753_100015370543 [0,2,0,0,0,0|2,0,0]=4 6472 B16R1.688 CC/C=C\CCC(=O)COc1ccccc1 1458a_100000186222_100015370543 [0,2,0,0,0,0|1,0,0]=3 6473 B16R1.688 CC/C=C\CCC(=O)COc1ccccn1 1458a_100102699861_100015370543 [0,2,0,0,0,0|2,0,0]=4 6474 B16R1.688 CC/C=C\CCC(=O)COc1cccnc1 1458a_100015207166_100015370543 [0,2,0,0,0,0|2,0,0]=4 6475 B16R1.688 CC/C=C\CCC(=O)CSc1ccccc1 1458a_100000211596_100015370543 [0,2,0,0,0,0|1,1,0]=4 6476 B16R1.688 CC/C=C\COC(C)COc1ccccc1 34a_100000210911_100103147603 [0,2,0,0,0,0|1,0,1]=4 6477 B16R1.688 CC/C=C\COC(C)COc1ccccc1 7a_100000210911_100103147603 [0,2,0,0,0,0|1,0,1]=4 6478 B16R1.688 CC=CCSCC(=O)CCc1ccccc1 62a_100000070051_100012361361 [0,2,0,0,0,0|1,1,0]=4 6479 B16R1.688 CC=CCSCC(=O)CCc1ccccc1 62a_100012361361_100000070051 [0,2,0,0,0,0|1,1,0]=4 6480 B16R1.688 CCCCOCC(=O)COc1ccccc1 1458a_100000186222_100011995733 [0,2,0,0,0,0|0,0,2]=4 6481 B16R1.688 CCCOCCC(=O)COc1ccccc1 1458a_100000186222_100011215938 [0,2,0,0,0,0|0,0,2]=4 6482 B16R1.688 CCOCCOC(=O)COc1ccccc1 34a_100000210340_200000101388 [0,2,0,0,0,0|0,0,2]=4 6483 B16R1.688 CCOCCOC(=O)COc1ccccc1 7a_100000210340_200000101388 [0,2,0,0,0,0|0,0,2]=4 6484 B16R1.688 N#CCOCCC(=O)COc1ccccc1 1458a_100000186222_200000047693 [0,2,0,0,0,0|1,0,1]=4 6485 B16R1.688 O=C(CCOCCO)COc1ccccc1 1458a_100000186222_100011215305 [0,2,0,0,0,0|1,0,1]=4 6486 B16R1.1216 C=CCCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000757094 [0,2,0,0,0,0|2,0,0]=4 6487 B16R1.1216 C=CCCCC(=O)C(C)Cc1ccccc1 1458a_100000766728_200011218536 [0,2,0,0,0,0|2,0,0]=4 6488 B16R1.1216 C=CCCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000757094 [0,2,0,0,0,0|1,0,0]=3 6489 B16R1.1216 C=CCCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000757094 [0,2,0,0,0,0|1,1,0]=4 6490 B16R1.1216 C=CCCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000757094 [0,2,0,0,0,0|2,0,0]=4 6491 B16R1.1216 C=CCCNC(=O)C(C)Cc1ccccc1 11a_100015191253_100000754839 [0,2,0,0,0,0|2,0,0]=4 6492 B16R1.1216 C=CCCNC(=O)C(C)Cc1ccccc1 1626a_100015191253_100000754839 [0,2,0,0,0,0|2,0,0]=4 6493 B16R1.1216 C=CCCNC(=O)C(C)Cc1ccccc1 240690a_100015191253_100000754839 [0,2,0,0,0,0|2,0,0]=4 6494 B16R1.1216 C=CCCNC(=O)C(C)Cc1ccccc1 527a_100015191253_100000754839 [0,2,0,0,0,0|2,0,0]=4 6495 B16R1.1216 C=CCCNC(=O)C(C)Oc1ccccc1 11a_100015191253_100000188414 [0,2,0,0,0,0|1,0,0]=3 6496 B16R1.1216 C=CCCNC(=O)C(C)Oc1ccccc1 1626a_100015191253_100000188414 [0,2,0,0,0,0|1,0,0]=3 6497 B16R1.1216 C=CCCNC(=O)C(C)Oc1ccccc1 240690a_100015191253_100000188414 [0,2,0,0,0,0|1,0,0]=3 6498 B16R1.1216 C=CCCNC(=O)C(C)Oc1ccccc1 527a_100015191253_100000188414 [0,2,0,0,0,0|1,0,0]=3 6499 B16R1.1216 C=CCCNC(=O)C(C)Sc1ccccc1 11a_100015191253_100000199063 [0,2,0,0,0,0|1,1,0]=4 6500 B16R1.1216 C=CCCNC(=O)C(C)Sc1ccccc1 1626a_100015191253_100000199063 [0,2,0,0,0,0|1,1,0]=4 6501 B16R1.1216 C=CCCNC(=O)C(C)Sc1ccccc1 240690a_100015191253_100000199063 [0,2,0,0,0,0|1,1,0]=4 6502 B16R1.1216 C=CCCNC(=O)C(C)Sc1ccccc1 527a_100015191253_100000199063 [0,2,0,0,0,0|1,1,0]=4 6503 B16R1.1216 C=CCCNC(=O)[C@H](O)Cc1ccccc1 240690a_100015191253_100009816399 [0,2,0,0,0,0|2,0,0]=4 6504 B16R1.1216 C=CCNNC(=O)C(C)Cc1ccccc1 22a_100020588587_100000754839 [0,2,0,0,0,0|2,0,0]=4 6505 B16R1.1216 C=CCNNC(=O)C(C)Oc1ccccc1 22a_100020588587_100000188414 [0,2,0,0,0,0|1,0,0]=3 6506 B16R1.1216 C=CCNNC(=O)C(C)Sc1ccccc1 22a_100020588587_100000199063 [0,2,0,0,0,0|1,1,0]=4 6507 B16R1.1216 C=CCNNC(=O)[C@H](O)Cc1ccccc1 22a_100020588587_100009816399 [0,2,0,0,0,0|2,0,0]=4 6508 B16R1.1216 C=CCOCC(=O)N(C)Cc1ccccc1 34a_200000210373_100000182870 [0,2,0,0,0,0|2,0,0]=4 6509 B16R1.1216 C=CCSCC(=O)C(C)Cc1ccccc1 1458a_100000230395_200011218536 [0,2,0,0,0,0|1,1,0]=4 6510 B16R1.1216 C=COCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000039644 [0,2,0,0,0,0|2,0,0]=4 6511 B16R1.1216 C=COCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000039644 [0,2,0,0,0,0|1,0,0]=3 6512 B16R1.1216 C=COCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000039644 [0,2,0,0,0,0|1,1,0]=4 6513 B16R1.1216 C=COCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000039644 [0,2,0,0,0,0|2,0,0]=4 6514 B16R1.1216 CCCCOC(=O)C(C)Oc1ccccc1 34a_100000210340_100000759602 [0,2,0,0,0,0|0,0,2]=4 6515 B16R1.1216 CCCCOC(=O)C(C)Oc1ccccc1 7a_100000210340_100000759602 [0,2,0,0,0,0|0,0,2]=4 6516 B16R1.1343 C=C(C#N)COC(C)COc1ccccc1 34a_100000210911_100000694840 [0,2,0,0,0,0|1,0,1]=4 6517 B16R1.1343 C=CC(=NNC(=O)COc1ccccc1)C 4a_100000186219_200015361842 [0,2,0,0,0,0|1,0,1]=4 6518 B16R1.1343 C=CC(=O)NNC(=O)COc1ccccc1 22a_100000186219_100000185746 [0,2,0,0,0,0|1,0,1]=4 6519 B16R1.1343 C=CC(C)OCC(=O)CCc1ccccc1 34a_100000695699_100012361361 [0,2,0,0,0,0|1,0,0]=3 6520 B16R1.1343 C=CC(C)OCC(=O)NCc1ccccc1 34a_100000695699_100000183539 [0,2,0,0,0,0|2,0,0]=4 6521 B16R1.1343 C=CC(C)OCC(=O)OCc1ccccc1 34a_100000695699_100000753625 [0,2,0,0,0,0|2,0,0]=4 6522 B16R1.1343 C=CC(C)SCC(=O)CCc1ccccc1 62a_100011215867_100012361361 [0,2,0,0,0,0|1,1,0]=4 6523 B16R1.1343 C=CC(O)COC(C)COc1ccccc1 34a_100000210911_100000730141 [0,2,0,0,0,0|1,0,1]=4 6524 B16R1.1343 C=CC(O)COC(C)COc1ccccc1 7a_100000210911_100000730141 [0,2,0,0,0,0|1,0,1]=4 6525 B16R1.1343 CCC(=O)CNC(=O)COc1ccccc1 1458a_100000185185_100000210202 [0,2,0,0,0,0|1,0,1]=4 6526 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 11a_100000693194_100000186222 [0,2,0,0,0,0|1,0,1]=4 6527 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 11a_106832991635_100000185185 [0,2,0,0,0,0|1,0,1]=4 6528 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 240690a_100000693194_100000186222 [0,2,0,0,0,0|1,0,1]=4 6529 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 240690a_100102657272_100000185185 [0,2,0,0,0,0|1,0,1]=4 6530 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 527a_100000693194_100000186222 [0,2,0,0,0,0|1,0,1]=4 6531 B16R1.1343 CNC(=O)CNC(=O)COc1ccccc1 527a_100102657272_100000185185 [0,2,0,0,0,0|1,0,1]=4 6532 B16R1.1343 COC(=O)CCC(=O)COc1ccccc1 34a_100000210340_100000691467 [0,2,0,0,0,0|1,0,1]=4 6533 B16R1.1343 COC(=O)CCC(=O)COc1ccccc1 7a_100000210340_100000691467 [0,2,0,0,0,0|1,0,1]=4 6534 B16R1.1343 COC(=O)CNC(=O)COc1ccccc1 188690a_100000185156_100000186222 [0,2,0,0,0,0|1,0,1]=4 6535 B16R1.1343 COC(=O)CNC(=O)COc1ccccc1 34a_100000210340_100000182966 [0,2,0,0,0,0|1,0,1]=4 6536 B16R1.1343 COC(=O)CNC(=O)COc1ccccc1 7a_100000210340_100000182966 [0,2,0,0,0,0|1,0,1]=4 6537 B16R1.1343 O=C(CF)CNC(=O)COc1ccccc1 1458a_100000185185_100015361967 [0,2,0,0,0,0|1,0,1]=4 6538 B16R1.1570 C=CCC(=O)CC(=O)CCc1ccccc1 1458a_100000210193_100012361361 [0,2,0,0,0,0|2,0,0]=4 6539 B16R1.1570 C=CCN(C)CC(=O)CCc1ccccc1 2230a_100000225617_100012361361 [0,2,0,0,0,0|2,0,0]=4 6540 B16R1.1570 C=CCN(C)CC(=O)CCc1ccccc1 269982a_100000225617_100012361361 [0,2,0,0,0,0|2,0,0]=4 6541 B16R1.1570 C=COC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000036128 [0,2,0,0,0,0|1,0,1]=4 6542 B16R1.1696 C/C=C/COC(C)COc1ccccc1C 34a_200011217337_100102629194 [0,2,0,0,0,0|1,0,1]=4 6543 B16R1.1696 C/C=C/COC(C)COc1ccccc1C 7a_200011217337_100102629194 [0,2,0,0,0,0|1,0,1]=4 6544 B16R1.1696 C=CCCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000757094 [0,2,0,0,0,0|2,0,0]=4 6545 B16R1.1696 C=CCCCC(=O)CCc1ccccc1Br 1458a_100000766728_100012161201 [0,2,0,0,0,0|2,0,0]=4 6546 B16R1.1696 C=CCCCC(=O)CCc1ccccc1C 1458a_100000748742_100000757094 [0,2,0,0,0,0|2,0,0]=4 6547 B16R1.1696 C=CCCCC(=O)CCc1ccccc1C 1458a_100000766728_100011713688 [0,2,0,0,0,0|2,0,0]=4 6548 B16R1.1696 C=CCCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000757094 [0,2,0,0,0,0|2,0,0]=4 6549 B16R1.1696 C=CCCCC(=O)CCc1ccccc1Cl 1458a_100000766728_100011713703 [0,2,0,0,0,0|2,0,0]=4 6550 B16R1.1696 C=CCCCC(=O)CCc1ccccc1F 1458a_100000189703_100000757094 [0,2,0,0,0,0|2,0,0]=4 6551 B16R1.1696 C=CCCCC(=O)CCc1ccccc1F 1458a_100000766728_100000720011 [0,2,0,0,0,0|2,0,0]=4 6552 B16R1.1696 C=CCCCC(=O)CCc1ccccc1I 1458a_100000037306_100000757094 [0,2,0,0,0,0|2,0,0]=4 6553 B16R1.1696 C=CCCCC(=O)CCc1ccccc1O 1458a_100000181328_100000757094 [0,2,0,0,0,0|2,0,0]=4 6554 B16R1.1696 C=CCCCC(=O)CCc1ccccc1O 1458a_100000766728_100000722297 [0,2,0,0,0,0|2,0,0]=4 6555 B16R1.1696 C=CCCCC(=O)COc1ccccc1Br 1458a_100000216496_100000757094 [0,2,0,0,0,0|1,0,0]=3 6556 B16R1.1696 C=CCCCC(=O)COc1ccccc1C 1458a_100000182418_100000757094 [0,2,0,0,0,0|1,0,0]=3 6557 B16R1.1696 C=CCCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000757094 [0,2,0,0,0,0|1,0,0]=3 6558 B16R1.1696 C=CCCCC(=O)COc1ccccc1F 1458a_100000182486_100000757094 [0,2,0,0,0,0|1,0,0]=3 6559 B16R1.1696 C=CCCCC(=O)COc1ccccc1O 1458a_100000183020_100000757094 [0,2,0,0,0,0|1,0,0]=3 6560 B16R1.1696 C=CCCCC(=O)CSc1ccccc1C 1458a_100000183026_100000757094 [0,2,0,0,0,0|1,1,0]=4 6561 B16R1.1696 C=CCCCC(=O)CSc1ccccc1F 1458a_100000179528_100000757094 [0,2,0,0,0,0|1,1,0]=4 6562 B16R1.1696 C=CCCCC(=O)CSc1ccccc1O 1458a_100000695322_100000757094 [0,2,0,0,0,0|1,1,0]=4 6563 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Br 11a_100015191253_100000740810 [0,2,0,0,0,0|2,0,0]=4 6564 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Br 1626a_100015191253_100000740810 [0,2,0,0,0,0|2,0,0]=4 6565 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Br 240690a_100015191253_100000740810 [0,2,0,0,0,0|2,0,0]=4 6566 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Br 527a_100015191253_100000740810 [0,2,0,0,0,0|2,0,0]=4 6567 B16R1.1696 C=CCCNC(=O)CCc1ccccc1C 11a_100015191253_100000748742 [0,2,0,0,0,0|2,0,0]=4 6568 B16R1.1696 C=CCCNC(=O)CCc1ccccc1C 1626a_100015191253_100000748742 [0,2,0,0,0,0|2,0,0]=4 6569 B16R1.1696 C=CCCNC(=O)CCc1ccccc1C 240690a_100015191253_100000748742 [0,2,0,0,0,0|2,0,0]=4 6570 B16R1.1696 C=CCCNC(=O)CCc1ccccc1C 527a_100015191253_100000748742 [0,2,0,0,0,0|2,0,0]=4 6571 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Cl 11a_100015191253_100000184300 [0,2,0,0,0,0|2,0,0]=4 6572 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Cl 1626a_100015191253_100000184300 [0,2,0,0,0,0|2,0,0]=4 6573 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Cl 240690a_100015191253_100000184300 [0,2,0,0,0,0|2,0,0]=4 6574 B16R1.1696 C=CCCNC(=O)CCc1ccccc1Cl 527a_100015191253_100000184300 [0,2,0,0,0,0|2,0,0]=4 6575 B16R1.1696 C=CCCNC(=O)CCc1ccccc1F 11a_100015191253_100000189703 [0,2,0,0,0,0|2,0,0]=4 6576 B16R1.1696 C=CCCNC(=O)CCc1ccccc1F 1626a_100015191253_100000189703 [0,2,0,0,0,0|2,0,0]=4 6577 B16R1.1696 C=CCCNC(=O)CCc1ccccc1F 240690a_100015191253_100000189703 [0,2,0,0,0,0|2,0,0]=4 6578 B16R1.1696 C=CCCNC(=O)CCc1ccccc1F 527a_100015191253_100000189703 [0,2,0,0,0,0|2,0,0]=4 6579 B16R1.1696 C=CCCNC(=O)CCc1ccccc1I 11a_100015191253_100000037306 [0,2,0,0,0,0|2,0,0]=4 6580 B16R1.1696 C=CCCNC(=O)CCc1ccccc1I 1626a_100015191253_100000037306 [0,2,0,0,0,0|2,0,0]=4 6581 B16R1.1696 C=CCCNC(=O)CCc1ccccc1I 240690a_100015191253_100000037306 [0,2,0,0,0,0|2,0,0]=4 6582 B16R1.1696 C=CCCNC(=O)CCc1ccccc1I 527a_100015191253_100000037306 [0,2,0,0,0,0|2,0,0]=4 6583 B16R1.1696 C=CCCNC(=O)CCc1ccccc1O 11a_100015191253_100000181328 [0,2,0,0,0,0|2,0,0]=4 6584 B16R1.1696 C=CCCNC(=O)CCc1ccccc1O 240690a_100015191253_100000181328 [0,2,0,0,0,0|2,0,0]=4 6585 B16R1.1696 C=CCCNC(=O)CCc1ccccc1O 527a_100015191253_100000181328 [0,2,0,0,0,0|2,0,0]=4 6586 B16R1.1696 C=CCCNC(=O)COc1ccccc1Br 11a_100015191253_100000216496 [0,2,0,0,0,0|1,0,0]=3 6587 B16R1.1696 C=CCCNC(=O)COc1ccccc1Br 1626a_100015191253_100000216496 [0,2,0,0,0,0|1,0,0]=3 6588 B16R1.1696 C=CCCNC(=O)COc1ccccc1Br 240690a_100015191253_100000216496 [0,2,0,0,0,0|1,0,0]=3 6589 B16R1.1696 C=CCCNC(=O)COc1ccccc1Br 527a_100015191253_100000216496 [0,2,0,0,0,0|1,0,0]=3 6590 B16R1.1696 C=CCCNC(=O)COc1ccccc1C 11a_100015191253_100000182418 [0,2,0,0,0,0|1,0,0]=3 6591 B16R1.1696 C=CCCNC(=O)COc1ccccc1C 1626a_100015191253_100000182418 [0,2,0,0,0,0|1,0,0]=3 6592 B16R1.1696 C=CCCNC(=O)COc1ccccc1C 240690a_100015191253_100000182418 [0,2,0,0,0,0|1,0,0]=3 6593 B16R1.1696 C=CCCNC(=O)COc1ccccc1C 527a_100015191253_100000182418 [0,2,0,0,0,0|1,0,0]=3 6594 B16R1.1696 C=CCCNC(=O)COc1ccccc1Cl 11a_100015191253_100000185159 [0,2,0,0,0,0|1,0,0]=3 6595 B16R1.1696 C=CCCNC(=O)COc1ccccc1Cl 1626a_100015191253_100000185159 [0,2,0,0,0,0|1,0,0]=3 6596 B16R1.1696 C=CCCNC(=O)COc1ccccc1Cl 240690a_100015191253_100000185159 [0,2,0,0,0,0|1,0,0]=3 6597 B16R1.1696 C=CCCNC(=O)COc1ccccc1Cl 527a_100015191253_100000185159 [0,2,0,0,0,0|1,0,0]=3 6598 B16R1.1696 C=CCCNC(=O)COc1ccccc1F 11a_100015191253_100000182486 [0,2,0,0,0,0|1,0,0]=3 6599 B16R1.1696 C=CCCNC(=O)COc1ccccc1F 1626a_100015191253_100000182486 [0,2,0,0,0,0|1,0,0]=3 6600 B16R1.1696 C=CCCNC(=O)COc1ccccc1F 240690a_100015191253_100000182486 [0,2,0,0,0,0|1,0,0]=3 6601 B16R1.1696 C=CCCNC(=O)COc1ccccc1F 527a_100015191253_100000182486 [0,2,0,0,0,0|1,0,0]=3 6602 B16R1.1696 C=CCCNC(=O)COc1ccccc1O 240690a_100015191253_100000183020 [0,2,0,0,0,0|1,0,0]=3 6603 B16R1.1696 C=CCCNC(=O)COc1ccccc1O 527a_100015191253_100000183020 [0,2,0,0,0,0|1,0,0]=3 6604 B16R1.1696 C=CCCNC(=O)CSc1ccccc1C 11a_100015191253_100000183026 [0,2,0,0,0,0|1,1,0]=4 6605 B16R1.1696 C=CCCNC(=O)CSc1ccccc1C 1626a_100015191253_100000183026 [0,2,0,0,0,0|1,1,0]=4 6606 B16R1.1696 C=CCCNC(=O)CSc1ccccc1C 240690a_100015191253_100000183026 [0,2,0,0,0,0|1,1,0]=4 6607 B16R1.1696 C=CCCNC(=O)CSc1ccccc1C 527a_100015191253_100000183026 [0,2,0,0,0,0|1,1,0]=4 6608 B16R1.1696 C=CCCNC(=O)CSc1ccccc1F 11a_100015191253_100000179528 [0,2,0,0,0,0|1,1,0]=4 6609 B16R1.1696 C=CCCNC(=O)CSc1ccccc1F 1626a_100015191253_100000179528 [0,2,0,0,0,0|1,1,0]=4 6610 B16R1.1696 C=CCCNC(=O)CSc1ccccc1F 240690a_100015191253_100000179528 [0,2,0,0,0,0|1,1,0]=4 6611 B16R1.1696 C=CCCNC(=O)CSc1ccccc1O 240690a_100015191253_100000695322 [0,2,0,0,0,0|1,1,0]=4 6612 B16R1.1696 C=CCCNC(=O)CSc1ccccc1O 527a_100015191253_100000695322 [0,2,0,0,0,0|1,1,0]=4 6613 B16R1.1696 C=CCCOC(C)COc1ccccc1C 34a_200011217337_100000754431 [0,2,0,0,0,0|1,0,1]=4 6614 B16R1.1696 C=CCCOC(C)COc1ccccc1C 7a_200011217337_100000754431 [0,2,0,0,0,0|1,0,1]=4 6615 B16R1.1696 C=CCNNC(=O)CCc1ccccc1Br 22a_100020588587_100000740810 [0,2,0,0,0,0|2,0,0]=4 6616 B16R1.1696 C=CCNNC(=O)CCc1ccccc1C 22a_100020588587_100000748742 [0,2,0,0,0,0|2,0,0]=4 6617 B16R1.1696 C=CCNNC(=O)CCc1ccccc1Cl 22a_100020588587_100000184300 [0,2,0,0,0,0|2,0,0]=4 6618 B16R1.1696 C=CCNNC(=O)CCc1ccccc1F 22a_100020588587_100000189703 [0,2,0,0,0,0|2,0,0]=4 6619 B16R1.1696 C=CCNNC(=O)CCc1ccccc1I 22a_100020588587_100000037306 [0,2,0,0,0,0|2,0,0]=4 6620 B16R1.1696 C=CCNNC(=O)CCc1ccccc1O 22a_100020588587_100000181328 [0,2,0,0,0,0|2,0,0]=4 6621 B16R1.1696 C=CCNNC(=O)COc1ccccc1Br 22a_100020588587_100000216496 [0,2,0,0,0,0|1,0,0]=3 6622 B16R1.1696 C=CCNNC(=O)COc1ccccc1C 22a_100020588587_100000182418 [0,2,0,0,0,0|1,0,0]=3 6623 B16R1.1696 C=CCNNC(=O)COc1ccccc1Cl 22a_100020588587_100000185159 [0,2,0,0,0,0|1,0,0]=3 6624 B16R1.1696 C=CCNNC(=O)COc1ccccc1F 22a_100020588587_100000182486 [0,2,0,0,0,0|1,0,0]=3 6625 B16R1.1696 C=CCNNC(=O)COc1ccccc1O 22a_100020588587_100000183020 [0,2,0,0,0,0|1,0,0]=3 6626 B16R1.1696 C=CCNNC(=O)CSc1ccccc1C 22a_100020588587_100000183026 [0,2,0,0,0,0|1,1,0]=4 6627 B16R1.1696 C=CCNNC(=O)CSc1ccccc1F 22a_100020588587_100000179528 [0,2,0,0,0,0|1,1,0]=4 6628 B16R1.1696 C=CCNNC(=O)CSc1ccccc1O 22a_100020588587_100000695322 [0,2,0,0,0,0|1,1,0]=4 6629 B16R1.1696 C=CCOCC(=O)NCc1ccccc1C 34a_200000210373_100000230231 [0,2,0,0,0,0|2,0,0]=4 6630 B16R1.1696 C=CCOCC(=O)NCc1ccccc1F 34a_200000210373_100000190583 [0,2,0,0,0,0|2,0,0]=4 6631 B16R1.1696 C=CCSCC(=O)CCc1ccccc1Br 1458a_100000230395_100012161201 [0,2,0,0,0,0|1,1,0]=4 6632 B16R1.1696 C=CCSCC(=O)CCc1ccccc1C 1458a_100000230395_100011713688 [0,2,0,0,0,0|1,1,0]=4 6633 B16R1.1696 C=CCSCC(=O)CCc1ccccc1Cl 1458a_100000230395_100011713703 [0,2,0,0,0,0|1,1,0]=4 6634 B16R1.1696 C=CCSCC(=O)CCc1ccccc1F 1458a_100000230395_100000720011 [0,2,0,0,0,0|1,1,0]=4 6635 B16R1.1696 C=CCSCC(=O)CCc1ccccc1O 1458a_100000230395_100000722297 [0,2,0,0,0,0|1,1,0]=4 6636 B16R1.1696 C=COCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000039644 [0,2,0,0,0,0|2,0,0]=4 6637 B16R1.1696 C=COCCC(=O)CCc1ccccc1C 1458a_100000748742_100000039644 [0,2,0,0,0,0|2,0,0]=4 6638 B16R1.1696 C=COCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000039644 [0,2,0,0,0,0|2,0,0]=4 6639 B16R1.1696 C=COCCC(=O)CCc1ccccc1F 1458a_100000189703_100000039644 [0,2,0,0,0,0|2,0,0]=4 6640 B16R1.1696 C=COCCC(=O)CCc1ccccc1I 1458a_100000037306_100000039644 [0,2,0,0,0,0|2,0,0]=4 6641 B16R1.1696 C=COCCC(=O)CCc1ccccc1O 1458a_100000181328_100000039644 [0,2,0,0,0,0|2,0,0]=4 6642 B16R1.1696 C=COCCC(=O)COc1ccccc1Br 1458a_100000216496_100000039644 [0,2,0,0,0,0|1,0,0]=3 6643 B16R1.1696 C=COCCC(=O)COc1ccccc1C 1458a_100000182418_100000039644 [0,2,0,0,0,0|1,0,0]=3 6644 B16R1.1696 C=COCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000039644 [0,2,0,0,0,0|1,0,0]=3 6645 B16R1.1696 C=COCCC(=O)COc1ccccc1F 1458a_100000182486_100000039644 [0,2,0,0,0,0|1,0,0]=3 6646 B16R1.1696 C=COCCC(=O)COc1ccccc1O 1458a_100000183020_100000039644 [0,2,0,0,0,0|1,0,0]=3 6647 B16R1.1696 C=COCCC(=O)CSc1ccccc1C 1458a_100000183026_100000039644 [0,2,0,0,0,0|1,1,0]=4 6648 B16R1.1696 C=COCCC(=O)CSc1ccccc1F 1458a_100000179528_100000039644 [0,2,0,0,0,0|1,1,0]=4 6649 B16R1.1696 C=COCCC(=O)CSc1ccccc1O 1458a_100000695322_100000039644 [0,2,0,0,0,0|1,1,0]=4 6650 B16R1.1696 CC=CCOC(C)COc1ccccc1C 34a_200011217337_100000070051 [0,2,0,0,0,0|1,0,1]=4 6651 B16R1.1696 CC=CCOC(C)COc1ccccc1C 7a_200011217337_100000070051 [0,2,0,0,0,0|1,0,1]=4 6652 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 34a_100000181306_100000211628 [0,2,0,0,0,0|0,0,2]=4 6653 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 7a_100000181306_100000211628 [0,2,0,0,0,0|0,0,2]=4 6654 B16R1.1696 CCCCOC(=O)COc1ccccc1C 34a_100000210338_100000211628 [0,2,0,0,0,0|0,0,2]=4 6655 B16R1.1696 CCCCOC(=O)COc1ccccc1C 7a_100000210338_100000211628 [0,2,0,0,0,0|0,0,2]=4 6656 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 34a_100000210172_100000211628 [0,2,0,0,0,0|0,0,2]=4 6657 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 7a_100000210172_100000211628 [0,2,0,0,0,0|0,0,2]=4 6658 B16R1.1696 CCCCOC(=O)COc1ccccc1F 34a_100000210171_100000211628 [0,2,0,0,0,0|0,0,2]=4 6659 B16R1.1696 CCCCOC(=O)COc1ccccc1F 7a_100000210171_100000211628 [0,2,0,0,0,0|0,0,2]=4 6660 B16R1.1696 CCCCOC(=O)COc1ccccc1I 34a_100000739446_100000211628 [0,2,0,0,0,0|0,0,2]=4 6661 B16R1.1696 CCCCOC(=O)COc1ccccc1I 7a_100000739446_100000211628 [0,2,0,0,0,0|0,0,2]=4 6662 B16R1.1696 CCCCOC(=O)COc1ccccc1N 34a_100000185747_100000211628 [0,2,0,0,0,0|0,0,2]=4 6663 B16R1.1696 CCCCOC(=O)COc1ccccc1N 7a_100000185747_100000211628 [0,2,0,0,0,0|0,0,2]=4 6664 B16R1.1696 COCCOC(=O)COc1ccccc1Br 34a_100000181306_200000040189 [0,2,0,0,0,0|0,0,2]=4 6665 B16R1.1696 COCCOC(=O)COc1ccccc1Br 7a_100000181306_200000040189 [0,2,0,0,0,0|0,0,2]=4 6666 B16R1.1696 COCCOC(=O)COc1ccccc1C 34a_100000210338_200000040189 [0,2,0,0,0,0|0,0,2]=4 6667 B16R1.1696 COCCOC(=O)COc1ccccc1C 7a_100000210338_200000040189 [0,2,0,0,0,0|0,0,2]=4 6668 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 34a_100000210172_200000040189 [0,2,0,0,0,0|0,0,2]=4 6669 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 7a_100000210172_200000040189 [0,2,0,0,0,0|0,0,2]=4 6670 B16R1.1696 COCCOC(=O)COc1ccccc1F 34a_100000210171_200000040189 [0,2,0,0,0,0|0,0,2]=4 6671 B16R1.1696 COCCOC(=O)COc1ccccc1F 7a_100000210171_200000040189 [0,2,0,0,0,0|0,0,2]=4 6672 B16R1.1696 COCCOC(=O)COc1ccccc1I 34a_100000739446_200000040189 [0,2,0,0,0,0|0,0,2]=4 6673 B16R1.1696 COCCOC(=O)COc1ccccc1I 7a_100000739446_200000040189 [0,2,0,0,0,0|0,0,2]=4 6674 B16R1.1696 COCCOC(=O)COc1ccccc1N 34a_100000185747_200000040189 [0,2,0,0,0,0|0,0,2]=4 6675 B16R1.1696 COCCOC(=O)COc1ccccc1N 7a_100000185747_200000040189 [0,2,0,0,0,0|0,0,2]=4 6676 B16R1.1758 C/C=C/COC(CN)COc1ccccc1 34a_100000738913_100102629194 [0,2,0,0,0,0|1,0,1]=4 6677 B16R1.1758 C=CCCOC(CN)COc1ccccc1 34a_100000738913_100000754431 [0,2,0,0,0,0|1,0,1]=4 6678 B16R1.1758 CC=CCOC(CN)COc1ccccc1 34a_100000738913_100000070051 [0,2,0,0,0,0|1,0,1]=4 6679 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000749702_100000188085 [0,2,0,0,0,0|2,0,0]=4 6680 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)C 1458a_100000749702_100000211441 [0,2,0,0,0,0|2,0,0]=4 6681 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000749702_100000211071 [0,2,0,0,0,0|2,0,0]=4 6682 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)F 1458a_100000749702_100000211279 [0,2,0,0,0,0|2,0,0]=4 6683 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)I 1458a_100000749702_100011216261 [0,2,0,0,0,0|2,0,0]=4 6684 B16R1.78 C=CCCC(=O)CC(=O)c1ccc(cc1)O 1458a_100000749702_100009814261 [0,2,0,0,0,0|2,0,0]=4 6685 B16R1.78 C=CCCC(=O)CC(C)c1ccc(cc1)C 1458a_100011240733_100000754431 [0,2,0,0,0,0|2,0,0]=4 6686 B16R1.78 C=CCCC(=O)CC(O)c1ccc(cc1)Cl 1458a_100000749702_200011996143 [0,2,0,0,0,0|2,0,0]=4 6687 B16R1.78 C=CCCC(=O)C[C@H](O)c1ccc(cc1)F 1458a_100000749702_100000720402 [0,2,0,0,0,0|2,0,0]=4 6688 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000183597 [0,2,0,0,0,0|2,0,0]=4 6689 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000183597 [0,2,0,0,0,0|2,0,0]=4 6690 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000183597 [0,2,0,0,0,0|2,0,0]=4 6691 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000183597 [0,2,0,0,0,0|2,0,0]=4 6692 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000183597 [0,2,0,0,0,0|2,0,0]=4 6693 B16R1.78 C=CCNC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000183597 [0,2,0,0,0,0|2,0,0]=4 6694 B16R1.78 C=CCNC(=O)CC(C)c1ccc(cc1)C 1626a_100020586998_100011240733 [0,2,0,0,0,0|2,0,0]=4 6695 B16R1.78 C=CCNC(=O)CC(C)c1ccc(cc1)C 240690a_100020586998_100011240733 [0,2,0,0,0,0|2,0,0]=4 6696 B16R1.78 C=CCNC(=O)CC(C)c1ccc(cc1)C 527a_100020586998_100011240733 [0,2,0,0,0,0|2,0,0]=4 6697 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)Br 2230a_100000219623_100000183597 [0,2,0,0,0,0|2,0,0]=4 6698 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000183597 [0,2,0,0,0,0|2,0,0]=4 6699 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)C 2230a_100000219977_100000183597 [0,2,0,0,0,0|2,0,0]=4 6700 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)C 269982a_100000219977_100000183597 [0,2,0,0,0,0|2,0,0]=4 6701 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000183597 [0,2,0,0,0,0|2,0,0]=4 6702 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000183597 [0,2,0,0,0,0|2,0,0]=4 6703 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)F 2230a_100000219829_100000183597 [0,2,0,0,0,0|2,0,0]=4 6704 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)F 269982a_100000219829_100000183597 [0,2,0,0,0,0|2,0,0]=4 6705 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)I 2230a_100000743151_100000183597 [0,2,0,0,0,0|2,0,0]=4 6706 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)I 269982a_100000743151_100000183597 [0,2,0,0,0,0|2,0,0]=4 6707 B16R1.78 C=CCNC(=O)CN(C)c1ccc(cc1)O 269982a_100000182112_100000183597 [0,2,0,0,0,0|2,0,0]=4 6708 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000033060 [0,2,0,0,0,0|1,0,0]=3 6709 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000033060 [0,2,0,0,0,0|1,0,0]=3 6710 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000033060 [0,2,0,0,0,0|1,0,0]=3 6711 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000033060 [0,2,0,0,0,0|1,0,0]=3 6712 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000033060 [0,2,0,0,0,0|1,0,0]=3 6713 B16R1.78 C=CCOC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000033060 [0,2,0,0,0,0|1,0,0]=3 6714 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Br 2230a_100000219623_100000033060 [0,2,0,0,0,0|1,0,0]=3 6715 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000033060 [0,2,0,0,0,0|1,0,0]=3 6716 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Br 34a_100000219623_100000033060 [0,2,0,0,0,0|1,0,0]=3 6717 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)C 2230a_100000219977_100000033060 [0,2,0,0,0,0|1,0,0]=3 6718 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)C 269982a_100000219977_100000033060 [0,2,0,0,0,0|1,0,0]=3 6719 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)C 34a_100000219977_100000033060 [0,2,0,0,0,0|1,0,0]=3 6720 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000033060 [0,2,0,0,0,0|1,0,0]=3 6721 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000033060 [0,2,0,0,0,0|1,0,0]=3 6722 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000033060 [0,2,0,0,0,0|1,0,0]=3 6723 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)F 2230a_100000219829_100000033060 [0,2,0,0,0,0|1,0,0]=3 6724 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)F 269982a_100000219829_100000033060 [0,2,0,0,0,0|1,0,0]=3 6725 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)F 34a_100000219829_100000033060 [0,2,0,0,0,0|1,0,0]=3 6726 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)I 2230a_100000743151_100000033060 [0,2,0,0,0,0|1,0,0]=3 6727 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)I 269982a_100000743151_100000033060 [0,2,0,0,0,0|1,0,0]=3 6728 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)I 34a_100000743151_100000033060 [0,2,0,0,0,0|1,0,0]=3 6729 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)O 269982a_100000182112_100000033060 [0,2,0,0,0,0|1,0,0]=3 6730 B16R1.78 C=CCOC(=O)CN(C)c1ccc(cc1)O 34a_100000182112_100000033060 [0,2,0,0,0,0|1,0,0]=3 6731 B16R1.79 C=CCCC(=O)CC(=O)c1cccc(c1)Br 1458a_100000749702_100000212080 [0,2,0,0,0,0|2,0,0]=4 6732 B16R1.79 C=CCCC(=O)CC(=O)c1cccc(c1)C 1458a_100000749702_100000739480 [0,2,0,0,0,0|2,0,0]=4 6733 B16R1.79 C=CCCC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000749702_100000211444 [0,2,0,0,0,0|2,0,0]=4 6734 B16R1.79 C=CCCC(=O)CC(=O)c1cccc(c1)F 1458a_100000749702_100000215616 [0,2,0,0,0,0|2,0,0]=4 6735 B16R1.79 C=CCCC(=O)CC(=O)c1cccc(c1)O 1458a_100000749702_100009813753 [0,2,0,0,0,0|2,0,0]=4 6736 B16R1.79 C=CCCC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_100000754431 [0,2,0,0,0,0|2,0,0]=4 6737 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000183597 [0,2,0,0,0,0|2,0,0]=4 6738 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)C 1458a_100000189346_100000183597 [0,2,0,0,0,0|2,0,0]=4 6739 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000183597 [0,2,0,0,0,0|2,0,0]=4 6740 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)F 1458a_100000210950_100000183597 [0,2,0,0,0,0|2,0,0]=4 6741 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)I 1458a_100000184098_100000183597 [0,2,0,0,0,0|2,0,0]=4 6742 B16R1.79 C=CCNC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000183597 [0,2,0,0,0,0|2,0,0]=4 6743 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)Br 2230a_100000219648_100000183597 [0,2,0,0,0,0|2,0,0]=4 6744 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)Br 269982a_100000219648_100000183597 [0,2,0,0,0,0|2,0,0]=4 6745 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)C 2230a_100000219674_100000183597 [0,2,0,0,0,0|2,0,0]=4 6746 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)C 269982a_100000219674_100000183597 [0,2,0,0,0,0|2,0,0]=4 6747 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)Cl 2230a_100000220044_100000183597 [0,2,0,0,0,0|2,0,0]=4 6748 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000183597 [0,2,0,0,0,0|2,0,0]=4 6749 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)F 2230a_100020633736_100000183597 [0,2,0,0,0,0|2,0,0]=4 6750 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)F 269982a_100020633736_100000183597 [0,2,0,0,0,0|2,0,0]=4 6751 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)I 2230a_100000221217_100000183597 [0,2,0,0,0,0|2,0,0]=4 6752 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)I 269982a_100000221217_100000183597 [0,2,0,0,0,0|2,0,0]=4 6753 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)O 2230a_100000756613_100000183597 [0,2,0,0,0,0|2,0,0]=4 6754 B16R1.79 C=CCNC(=O)CN(C)c1cccc(c1)O 269982a_100000756613_100000183597 [0,2,0,0,0,0|2,0,0]=4 6755 B16R1.79 C=CCNC(=O)C[C@H](O)c1cccc(c1)Cl 240690a_100020586998_100010423400 [0,2,0,0,0,0|2,0,0]=4 6756 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000033060 [0,2,0,0,0,0|1,0,0]=3 6757 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)C 1458a_100000189346_100000033060 [0,2,0,0,0,0|1,0,0]=3 6758 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000033060 [0,2,0,0,0,0|1,0,0]=3 6759 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)F 1458a_100000210950_100000033060 [0,2,0,0,0,0|1,0,0]=3 6760 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)I 1458a_100000184098_100000033060 [0,2,0,0,0,0|1,0,0]=3 6761 B16R1.79 C=CCOC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000033060 [0,2,0,0,0,0|1,0,0]=3 6762 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Br 2230a_100000219648_100000033060 [0,2,0,0,0,0|1,0,0]=3 6763 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Br 269982a_100000219648_100000033060 [0,2,0,0,0,0|1,0,0]=3 6764 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Br 34a_100000219648_100000033060 [0,2,0,0,0,0|1,0,0]=3 6765 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)C 2230a_100000219674_100000033060 [0,2,0,0,0,0|1,0,0]=3 6766 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)C 269982a_100000219674_100000033060 [0,2,0,0,0,0|1,0,0]=3 6767 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)C 34a_100000219674_100000033060 [0,2,0,0,0,0|1,0,0]=3 6768 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Cl 2230a_100000220044_100000033060 [0,2,0,0,0,0|1,0,0]=3 6769 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000033060 [0,2,0,0,0,0|1,0,0]=3 6770 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)Cl 34a_100000220044_100000033060 [0,2,0,0,0,0|1,0,0]=3 6771 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)F 2230a_100020633736_100000033060 [0,2,0,0,0,0|1,0,0]=3 6772 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)F 269982a_100020633736_100000033060 [0,2,0,0,0,0|1,0,0]=3 6773 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)F 34a_100020633736_100000033060 [0,2,0,0,0,0|1,0,0]=3 6774 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)I 2230a_100000221217_100000033060 [0,2,0,0,0,0|1,0,0]=3 6775 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)I 269982a_100000221217_100000033060 [0,2,0,0,0,0|1,0,0]=3 6776 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)I 34a_100000221217_100000033060 [0,2,0,0,0,0|1,0,0]=3 6777 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)O 2230a_100000756613_100000033060 [0,2,0,0,0,0|1,0,0]=3 6778 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)O 269982a_100000756613_100000033060 [0,2,0,0,0,0|1,0,0]=3 6779 B16R1.79 C=CCOC(=O)CN(C)c1cccc(c1)O 34a_100000756613_100000033060 [0,2,0,0,0,0|1,0,0]=3 6780 B16R1.847 C=CC(C)CC(=O)CC(=O)c1ccccc1 1458a_100011934298_100000211460 [0,2,0,0,0,0|2,0,0]=4 6781 B16R1.847 C=CC(C)CC(=O)CC(C)c1ccccc1 1458a_100011934298_100000756946 [0,2,0,0,0,0|2,0,0]=4 6782 B16R1.847 C=CC(C)CC(=O)CC(O)c1ccccc1 1458a_100011934298_100000185958 [0,2,0,0,0,0|2,0,0]=4 6783 B16R1.847 C=CC(C)CC(=O)C[C@@H](O)c1ccccc1 1458a_100011934298_100011933945 [0,2,0,0,0,0|2,0,0]=4 6784 B16R1.912 C=CCC(C)C(=O)CC(=O)c1ccccc1 1458a_100011216819_100000211460 [0,2,0,0,0,0|2,0,0]=4 6785 B16R1.912 C=CCC(C)C(=O)CC(C)c1ccccc1 1458a_100011216819_100000756946 [0,2,0,0,0,0|2,0,0]=4 6786 B16R1.912 C=CCC(C)C(=O)CC(O)c1ccccc1 1458a_100011216819_100000185958 [0,2,0,0,0,0|2,0,0]=4 6787 B16R1.912 C=CCC(C)C(=O)C[C@@H](O)c1ccccc1 1458a_100011216819_100011933945 [0,2,0,0,0,0|2,0,0]=4 6788 B16R1.912 C=CCN(C)C(=O)CC(C)c1ccccc1 11a_100000225617_100000183687 [0,2,0,0,0,0|2,0,0]=4 6789 B16R1.912 C=CCN(C)C(=O)CC(C)c1ccccc1 1626a_100000225617_100000183687 [0,2,0,0,0,0|2,0,0]=4 6790 B16R1.912 C=CCN(C)C(=O)CC(C)c1ccccc1 240690a_100000225617_100000183687 [0,2,0,0,0,0|2,0,0]=4 6791 B16R1.912 C=CCN(C)C(=O)CC(C)c1ccccc1 527a_100000225617_100000183687 [0,2,0,0,0,0|2,0,0]=4 6792 B16R1.912 C=CCN(C)C(=O)CC(O)c1ccccc1 240690a_100000225617_100000690199 [0,2,0,0,0,0|2,0,0]=4 6793 B16R1.912 C=CCN(C)C(=O)CN(C)c1ccccc1 240690a_100000225617_100000745425 [0,2,0,0,0,0|2,0,0]=4 6794 B16R1.912 C=CCN(C)C(=O)CN(C)c1ccccc1 527a_100000225617_100000745425 [0,2,0,0,0,0|2,0,0]=4 6795 B16R1.1244 C=CCCC(=O)C(C)C(=O)c1ccccc1 1458a_100000749702_100000239700 [0,2,0,0,0,0|2,0,0]=4 6796 B16R1.1244 C=CCNC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000230288 [0,2,0,0,0,0|2,0,0]=4 6797 B16R1.1244 C=CCNC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100000230288 [0,2,0,0,0,0|2,0,0]=4 6798 B16R1.1244 C=CCNC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100000230288 [0,2,0,0,0,0|2,0,0]=4 6799 B16R1.1495 C=CCCC(=O)CC(C)(C)c1ccccc1 1458a_100011409233_100000754431 [0,2,0,0,0,0|2,0,0]=4 6800 B16R1.1495 C=CCCC(=O)CS(=O)(=O)c1ccccc1 1458a_100000187771_100000754431 [0,2,0,0,0,0|1,1,0]=4 6801 B16R1.1495 C=CCCC(=O)CS(=O)(=O)c1ccccc1 1458a_100000749702_100000240042 [0,2,0,0,0,0|1,1,0]=4 6802 B16R1.1495 C=CCCC(=O)C[Si](C)(C)c1ccccc1 1458a_100000749702_100000038972 [0,2,0,0,0,0|2,0,0]=4 6803 B16R1.1495 C=CCNC(=O)CC(C)(C)c1ccccc1 1626a_100020586998_100011409233 [0,2,0,0,0,0|2,0,0]=4 6804 B16R1.1495 C=CCNC(=O)CC(C)(C)c1ccccc1 240690a_100020586998_100011409233 [0,2,0,0,0,0|2,0,0]=4 6805 B16R1.1495 C=CCNC(=O)CC(C)(C)c1ccccc1 527a_100020586998_100011409233 [0,2,0,0,0,0|2,0,0]=4 6806 B16R1.1495 C=CCNC(=O)CS(=O)(=O)c1ccccc1 1626a_100020586998_100000187771 [0,2,0,0,0,0|1,1,0]=4 6807 B16R1.1495 C=CCNC(=O)CS(=O)(=O)c1ccccc1 240690a_100020586998_100000187771 [0,2,0,0,0,0|1,1,0]=4 6808 B16R1.1495 C=CCNC(=O)CS(=O)(=O)c1ccccc1 527a_100020586998_100000187771 [0,2,0,0,0,0|1,1,0]=4 6809 B16R1.4478 C=CCCC(=O)CC(C#N)c1ccccc1 1458a_200000079825_100000754431 [0,2,0,0,0,0|2,0,0]=4 6810 B16R1.4478 C=CCCC(=O)CC(CO)c1ccccc1 1458a_106726389045_100000754431 [0,2,0,0,0,0|2,0,0]=4 6811 B16R1.4478 C=CCNC(=O)CC(C#N)c1ccccc1 1626a_100020586998_200000079825 [0,2,0,0,0,0|2,0,0]=4 6812 B16R1.4478 C=CCNC(=O)CC(C#N)c1ccccc1 240690a_100020586998_200000079825 [0,2,0,0,0,0|2,0,0]=4 6813 B16R1.4478 C=CCNC(=O)CC(C#N)c1ccccc1 527a_100020586998_200000079825 [0,2,0,0,0,0|2,0,0]=4 6814 B16R1.4478 C=CCNC(=O)CC(CO)c1ccccc1 1626a_100020586998_106726389045 [0,2,0,0,0,0|2,0,0]=4 6815 B16R1.4478 C=CCNC(=O)CC(CO)c1ccccc1 240690a_100020586998_106726389045 [0,2,0,0,0,0|2,0,0]=4 6816 B16R1.4478 C=CCNC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000183597 [0,2,0,0,0,0|2,0,0]=4 6817 B16R1.4478 C=CCNC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000183597 [0,2,0,0,0,0|2,0,0]=4 6818 B16R1.4478 C=CCOC(=O)CN(CC)c1ccccc1 2230a_100000210013_100000033060 [0,2,0,0,0,0|1,0,0]=3 6819 B16R1.4478 C=CCOC(=O)CN(CC)c1ccccc1 269982a_100000210013_100000033060 [0,2,0,0,0,0|1,0,0]=3 6820 B16R1.4478 C=CCOC(=O)CN(CC)c1ccccc1 34a_100000210013_100000033060 [0,2,0,0,0,0|1,0,0]=3 6821 B16R1.7010 C=CCCC(=O)CC(=O)c1ccccc1Br 1458a_100000749702_100000199116 [0,2,0,0,0,0|2,0,0]=4 6822 B16R1.7010 C=CCCC(=O)CC(=O)c1ccccc1C 1458a_100000749702_100000741374 [0,2,0,0,0,0|2,0,0]=4 6823 B16R1.7010 C=CCCC(=O)CC(=O)c1ccccc1Cl 1458a_100000749702_100000211432 [0,2,0,0,0,0|2,0,0]=4 6824 B16R1.7010 C=CCCC(=O)CC(=O)c1ccccc1F 1458a_100000749702_100000204681 [0,2,0,0,0,0|2,0,0]=4 6825 B16R1.7010 C=CCCC(=O)CC(=O)c1ccccc1O 1458a_100000749702_100000188908 [0,2,0,0,0,0|2,0,0]=4 6826 B16R1.7010 C=CCCC(=O)CC(C)c1ccccc1Br 1458a_100000743458_100000754431 [0,2,0,0,0,0|2,0,0]=4 6827 B16R1.7010 C=CCCC(=O)CC(C)c1ccccc1Cl 1458a_100012184337_100000754431 [0,2,0,0,0,0|2,0,0]=4 6828 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000183597 [0,2,0,0,0,0|2,0,0]=4 6829 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000183597 [0,2,0,0,0,0|2,0,0]=4 6830 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000183597 [0,2,0,0,0,0|2,0,0]=4 6831 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000183597 [0,2,0,0,0,0|2,0,0]=4 6832 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000183597 [0,2,0,0,0,0|2,0,0]=4 6833 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183597 [0,2,0,0,0,0|2,0,0]=4 6834 B16R1.7010 C=CCNC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000183597 [0,2,0,0,0,0|2,0,0]=4 6835 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Br 1626a_100020586998_100000743458 [0,2,0,0,0,0|2,0,0]=4 6836 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Br 240690a_100020586998_100000743458 [0,2,0,0,0,0|2,0,0]=4 6837 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Br 527a_100020586998_100000743458 [0,2,0,0,0,0|2,0,0]=4 6838 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Cl 1626a_100020586998_100012184337 [0,2,0,0,0,0|2,0,0]=4 6839 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Cl 240690a_100020586998_100012184337 [0,2,0,0,0,0|2,0,0]=4 6840 B16R1.7010 C=CCNC(=O)CC(C)c1ccccc1Cl 527a_100020586998_100012184337 [0,2,0,0,0,0|2,0,0]=4 6841 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1Br 2230a_100020606079_100000183597 [0,2,0,0,0,0|2,0,0]=4 6842 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1Br 269982a_100020606079_100000183597 [0,2,0,0,0,0|2,0,0]=4 6843 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000183597 [0,2,0,0,0,0|2,0,0]=4 6844 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000183597 [0,2,0,0,0,0|2,0,0]=4 6845 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1Cl 2230a_100000219374_100000183597 [0,2,0,0,0,0|2,0,0]=4 6846 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1Cl 269982a_100000219374_100000183597 [0,2,0,0,0,0|2,0,0]=4 6847 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1F 2230a_100000220357_100000183597 [0,2,0,0,0,0|2,0,0]=4 6848 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1F 269982a_100000220357_100000183597 [0,2,0,0,0,0|2,0,0]=4 6849 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1F 38a_100000220357_100000183597 [0,2,0,0,0,0|2,0,0]=4 6850 B16R1.7010 C=CCNC(=O)CN(C)c1ccccc1O 269982a_100000033821_100000183597 [0,2,0,0,0,0|2,0,0]=4 6851 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000033060 [0,2,0,0,0,0|1,0,0]=3 6852 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000033060 [0,2,0,0,0,0|1,0,0]=3 6853 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000033060 [0,2,0,0,0,0|1,0,0]=3 6854 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000033060 [0,2,0,0,0,0|1,0,0]=3 6855 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000033060 [0,2,0,0,0,0|1,0,0]=3 6856 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000033060 [0,2,0,0,0,0|1,0,0]=3 6857 B16R1.7010 C=CCOC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000033060 [0,2,0,0,0,0|1,0,0]=3 6858 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Br 2230a_100020606079_100000033060 [0,2,0,0,0,0|1,0,0]=3 6859 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Br 269982a_100020606079_100000033060 [0,2,0,0,0,0|1,0,0]=3 6860 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Br 34a_100020606079_100000033060 [0,2,0,0,0,0|1,0,0]=3 6861 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1C 2230a_100000219699_100000033060 [0,2,0,0,0,0|1,0,0]=3 6862 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1C 269982a_100000219699_100000033060 [0,2,0,0,0,0|1,0,0]=3 6863 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1C 34a_100000219699_100000033060 [0,2,0,0,0,0|1,0,0]=3 6864 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Cl 2230a_100000219374_100000033060 [0,2,0,0,0,0|1,0,0]=3 6865 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Cl 269982a_100000219374_100000033060 [0,2,0,0,0,0|1,0,0]=3 6866 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1Cl 34a_100000219374_100000033060 [0,2,0,0,0,0|1,0,0]=3 6867 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1F 2230a_100000220357_100000033060 [0,2,0,0,0,0|1,0,0]=3 6868 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1F 269982a_100000220357_100000033060 [0,2,0,0,0,0|1,0,0]=3 6869 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1F 34a_100000220357_100000033060 [0,2,0,0,0,0|1,0,0]=3 6870 B16R1.7010 C=CCOC(=O)CN(C)c1ccccc1O 269982a_100000033821_100000033060 [0,2,0,0,0,0|1,0,0]=3 6871 B16R1.7611 C=C(C)CCC(=O)CC(=O)c1ccccc1 1458a_200000688413_100000211460 [0,2,0,0,0,0|2,0,0]=4 6872 B16R1.7611 C=C(C)CCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000730704 [0,2,0,0,0,0|2,0,0]=4 6873 B16R1.7611 C=C(C)CCC(=O)CC(C)c1ccccc1 1458a_200000688413_100000756946 [0,2,0,0,0,0|2,0,0]=4 6874 B16R1.7611 C=C(C)CCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000730704 [0,2,0,0,0,0|2,0,0]=4 6875 B16R1.7611 C=C(C)CCC(=O)CC(O)c1ccccc1 1458a_200000688413_100000185958 [0,2,0,0,0,0|2,0,0]=4 6876 B16R1.7611 C=C(C)CCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000730704 [0,2,0,0,0,0|2,0,0]=4 6877 B16R1.7611 C=C(C)CCC(=O)C[C@@H](O)c1ccccc1 1458a_200000688413_100011933945 [0,2,0,0,0,0|2,0,0]=4 6878 B16R1.7611 C=C(C)CNC(=O)CC(C)c1ccccc1 11a_100000765925_100000183687 [0,2,0,0,0,0|2,0,0]=4 6879 B16R1.7611 C=C(C)CNC(=O)CC(C)c1ccccc1 1626a_100000765925_100000183687 [0,2,0,0,0,0|2,0,0]=4 6880 B16R1.7611 C=C(C)CNC(=O)CC(C)c1ccccc1 240690a_100000765925_100000183687 [0,2,0,0,0,0|2,0,0]=4 6881 B16R1.7611 C=C(C)CNC(=O)CC(C)c1ccccc1 527a_100000765925_100000183687 [0,2,0,0,0,0|2,0,0]=4 6882 B16R1.7611 C=C(C)CNC(=O)CC(O)c1ccccc1 240690a_100000765925_100000690199 [0,2,0,0,0,0|2,0,0]=4 6883 B16R1.7611 C=C(C)CNC(=O)CN(C)c1ccccc1 240690a_100000765925_100000745425 [0,2,0,0,0,0|2,0,0]=4 6884 B16R1.7611 C=C(C)CNC(=O)CN(C)c1ccccc1 527a_100000765925_100000745425 [0,2,0,0,0,0|2,0,0]=4 6885 B16R1.87 C=CCCC(=O)CCc1cccc(c1C)C 1458a_100011218151_100000754431 [0,2,0,0,0,0|2,0,0]=4 6886 B16R1.87 C=CCCC(=O)CCc1cccc(c1C)F 1458a_100000069055_100000754431 [0,2,0,0,0,0|2,0,0]=4 6887 B16R1.87 C=CCCC(=O)CCc1cccc(c1Cl)Cl 1458a_100000739359_100000754431 [0,2,0,0,0,0|2,0,0]=4 6888 B16R1.87 C=CCCC(=O)CCc1cccc(c1Cl)Cl 1458a_100000749702_100000723033 [0,2,0,0,0,0|2,0,0]=4 6889 B16R1.87 C=CCCC(=O)CCc1cccc(c1F)Br 1458a_100012349569_100000754431 [0,2,0,0,0,0|2,0,0]=4 6890 B16R1.87 C=CCCC(=O)CCc1cccc(c1F)Cl 1458a_100012349026_100000754431 [0,2,0,0,0,0|2,0,0]=4 6891 B16R1.87 C=CCCC(=O)CCc1cccc(c1F)F 1458a_100000748811_100000754431 [0,2,0,0,0,0|2,0,0]=4 6892 B16R1.87 C=CCCC(=O)CCc1cccc(c1O)O 1458a_100009873524_100000754431 [0,2,0,0,0,0|2,0,0]=4 6893 B16R1.87 C=CCCC(=O)COc1cccc(c1C)C 1458a_200000183798_100000754431 [0,2,0,0,0,0|1,0,0]=3 6894 B16R1.87 C=CCCC(=O)COc1cccc(c1Cl)Cl 1458a_100000191259_100000754431 [0,2,0,0,0,0|1,0,0]=3 6895 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)C 1626a_100020586998_100011218151 [0,2,0,0,0,0|2,0,0]=4 6896 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)C 240690a_100020586998_100011218151 [0,2,0,0,0,0|2,0,0]=4 6897 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)C 527a_100020586998_100011218151 [0,2,0,0,0,0|2,0,0]=4 6898 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)F 1626a_100020586998_100000069055 [0,2,0,0,0,0|2,0,0]=4 6899 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)F 240690a_100020586998_100000069055 [0,2,0,0,0,0|2,0,0]=4 6900 B16R1.87 C=CCNC(=O)CCc1cccc(c1C)F 527a_100020586998_100000069055 [0,2,0,0,0,0|2,0,0]=4 6901 B16R1.87 C=CCNC(=O)CCc1cccc(c1Cl)Cl 1626a_100020586998_100000739359 [0,2,0,0,0,0|2,0,0]=4 6902 B16R1.87 C=CCNC(=O)CCc1cccc(c1Cl)Cl 240690a_100020586998_100000739359 [0,2,0,0,0,0|2,0,0]=4 6903 B16R1.87 C=CCNC(=O)CCc1cccc(c1Cl)Cl 527a_100020586998_100000739359 [0,2,0,0,0,0|2,0,0]=4 6904 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Br 1626a_100020586998_100012349569 [0,2,0,0,0,0|2,0,0]=4 6905 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Br 240690a_100020586998_100012349569 [0,2,0,0,0,0|2,0,0]=4 6906 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Br 527a_100020586998_100012349569 [0,2,0,0,0,0|2,0,0]=4 6907 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Cl 1626a_100020586998_100012349026 [0,2,0,0,0,0|2,0,0]=4 6908 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Cl 240690a_100020586998_100012349026 [0,2,0,0,0,0|2,0,0]=4 6909 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)Cl 527a_100020586998_100012349026 [0,2,0,0,0,0|2,0,0]=4 6910 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)F 1626a_100020586998_100000748811 [0,2,0,0,0,0|2,0,0]=4 6911 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)F 240690a_100020586998_100000748811 [0,2,0,0,0,0|2,0,0]=4 6912 B16R1.87 C=CCNC(=O)CCc1cccc(c1F)F 527a_100020586998_100000748811 [0,2,0,0,0,0|2,0,0]=4 6913 B16R1.87 C=CCNC(=O)CCc1cccc(c1O)O 240690a_100020586998_100009873524 [0,2,0,0,0,0|2,0,0]=4 6914 B16R1.87 C=CCNC(=O)CCc1cccc(c1O)O 527a_100020586998_100009873524 [0,2,0,0,0,0|2,0,0]=4 6915 B16R1.87 C=CCNC(=O)CNc1cccc(c1Br)O 7a_100012183704_100000183597 [0,2,0,0,0,0|2,0,0]=4 6916 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)C 2230a_100000210026_100000183597 [0,2,0,0,0,0|2,0,0]=4 6917 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)C 7a_100000210026_100000183597 [0,2,0,0,0,0|2,0,0]=4 6918 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)Cl 2230a_100000210441_100000183597 [0,2,0,0,0,0|2,0,0]=4 6919 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)Cl 7a_100000210441_100000183597 [0,2,0,0,0,0|2,0,0]=4 6920 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)F 7a_100000745574_100000183597 [0,2,0,0,0,0|2,0,0]=4 6921 B16R1.87 C=CCNC(=O)CNc1cccc(c1C)O 7a_100011216573_100000183597 [0,2,0,0,0,0|2,0,0]=4 6922 B16R1.87 C=CCNC(=O)CNc1cccc(c1Cl)C 7a_100000765562_100000183597 [0,2,0,0,0,0|2,0,0]=4 6923 B16R1.87 C=CCNC(=O)CNc1cccc(c1Cl)O 7a_100012002038_100000183597 [0,2,0,0,0,0|2,0,0]=4 6924 B16R1.87 C=CCNC(=O)CNc1cccc(c1F)Br 2230a_100011935091_100000183597 [0,2,0,0,0,0|2,0,0]=4 6925 B16R1.87 C=CCNC(=O)CNc1cccc(c1F)C 2230a_100000697159_100000183597 [0,2,0,0,0,0|2,0,0]=4 6926 B16R1.87 C=CCNC(=O)CNc1cccc(c1F)C 7a_100000697159_100000183597 [0,2,0,0,0,0|2,0,0]=4 6927 B16R1.87 C=CCNC(=O)CNc1cccc(c1F)Cl 2230a_100000199060_100000183597 [0,2,0,0,0,0|2,0,0]=4 6928 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)Br 7a_100010187966_100000183597 [0,2,0,0,0,0|1,0,0]=3 6929 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)C 7a_100000686692_100000183597 [0,2,0,0,0,0|1,0,0]=3 6930 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)Cl 7a_100012348804_100000183597 [0,2,0,0,0,0|1,0,0]=3 6931 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)F 7a_100009820682_100000183597 [0,2,0,0,0,0|1,0,0]=3 6932 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)I 7a_100010187914_100000183597 [0,2,0,0,0,0|1,0,0]=3 6933 B16R1.87 C=CCNC(=O)COc1cccc(c1Br)N 7a_100012183704_100000183597 [0,2,0,0,0,0|1,0,0]=3 6934 B16R1.87 C=CCNC(=O)COc1cccc(c1C)Br 7a_100012002258_100000183597 [0,2,0,0,0,0|1,0,0]=3 6935 B16R1.87 C=CCNC(=O)COc1cccc(c1C)C 1626a_100020586998_200000183798 [0,2,0,0,0,0|1,0,0]=3 6936 B16R1.87 C=CCNC(=O)COc1cccc(c1C)C 240690a_100020586998_200000183798 [0,2,0,0,0,0|1,0,0]=3 6937 B16R1.87 C=CCNC(=O)COc1cccc(c1C)C 527a_100020586998_200000183798 [0,2,0,0,0,0|1,0,0]=3 6938 B16R1.87 C=CCNC(=O)COc1cccc(c1C)C 7a_100000185855_100000183597 [0,2,0,0,0,0|1,0,0]=3 6939 B16R1.87 C=CCNC(=O)COc1cccc(c1C)Cl 7a_100011265684_100000183597 [0,2,0,0,0,0|1,0,0]=3 6940 B16R1.87 C=CCNC(=O)COc1cccc(c1C)F 7a_100011217231_100000183597 [0,2,0,0,0,0|1,0,0]=3 6941 B16R1.87 C=CCNC(=O)COc1cccc(c1C)N 7a_100011216573_100000183597 [0,2,0,0,0,0|1,0,0]=3 6942 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)Br 7a_100010187913_100000183597 [0,2,0,0,0,0|1,0,0]=3 6943 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)C 7a_100000695629_100000183597 [0,2,0,0,0,0|1,0,0]=3 6944 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)Cl 1626a_100020586998_100000191259 [0,2,0,0,0,0|1,0,0]=3 6945 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)Cl 240690a_100020586998_100000191259 [0,2,0,0,0,0|1,0,0]=3 6946 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)Cl 527a_100020586998_100000191259 [0,2,0,0,0,0|1,0,0]=3 6947 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)Cl 7a_100000211076_100000183597 [0,2,0,0,0,0|1,0,0]=3 6948 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)F 7a_100000087408_100000183597 [0,2,0,0,0,0|1,0,0]=3 6949 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)I 7a_100000049636_100000183597 [0,2,0,0,0,0|1,0,0]=3 6950 B16R1.87 C=CCNC(=O)COc1cccc(c1Cl)N 7a_100012002038_100000183597 [0,2,0,0,0,0|1,0,0]=3 6951 B16R1.87 C=CCNC(=O)COc1cccc(c1F)Br 7a_100009817021_100000183597 [0,2,0,0,0,0|1,0,0]=3 6952 B16R1.87 C=CCNC(=O)COc1cccc(c1F)C 7a_100000751311_100000183597 [0,2,0,0,0,0|1,0,0]=3 6953 B16R1.87 C=CCNC(=O)COc1cccc(c1F)Cl 7a_100000687438_100000183597 [0,2,0,0,0,0|1,0,0]=3 6954 B16R1.87 C=CCNC(=O)COc1cccc(c1F)F 7a_100000751161_100000183597 [0,2,0,0,0,0|1,0,0]=3 6955 B16R1.87 C=CCNC(=O)COc1cccc(c1I)Br 7a_100010187912_100000183597 [0,2,0,0,0,0|1,0,0]=3 6956 B16R1.87 C=CCNC(=O)COc1cccc(c1I)C 7a_100010083724_100000183597 [0,2,0,0,0,0|1,0,0]=3 6957 B16R1.87 C=CCNC(=O)COc1cccc(c1I)Cl 7a_100000050174_100000183597 [0,2,0,0,0,0|1,0,0]=3 6958 B16R1.87 C=CCNC(=O)COc1cccc(c1I)F 7a_100000690913_100000183597 [0,2,0,0,0,0|1,0,0]=3 6959 B16R1.87 C=CCNC(=O)COc1cccc(c1N)Br 7a_100011934926_100000183597 [0,2,0,0,0,0|1,0,0]=3 6960 B16R1.87 C=CCNC(=O)COc1cccc(c1N)C 7a_100000743429_100000183597 [0,2,0,0,0,0|1,0,0]=3 6961 B16R1.87 C=CCNC(=O)COc1cccc(c1N)Cl 7a_100012022510_100000183597 [0,2,0,0,0,0|1,0,0]=3 6962 B16R1.87 C=CCNC(=O)COc1cccc(c1N)F 7a_100020591140_100000183597 [0,2,0,0,0,0|1,0,0]=3 6963 B16R1.87 C=CCNC(=O)COc1cccc(c1N)I 7a_200000049512_100000183597 [0,2,0,0,0,0|1,0,0]=3 6964 B16R1.87 C=CCNC(=O)COc1cccn(c1=O)C 7a_100000117616_100000183597 [0,2,0,0,0,0|2,0,0]=4 6965 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)Br 62a_100000183597_100010175083 [0,2,0,0,0,0|1,1,0]=4 6966 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)Br 62a_100010175083_100000183597 [0,2,0,0,0,0|1,1,0]=4 6967 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)C 62a_100000183597_100012362457 [0,2,0,0,0,0|1,1,0]=4 6968 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)C 62a_100012362457_100000183597 [0,2,0,0,0,0|1,1,0]=4 6969 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)Cl 62a_100000183597_100014021842 [0,2,0,0,0,0|1,1,0]=4 6970 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)Cl 62a_100014021842_100000183597 [0,2,0,0,0,0|1,1,0]=4 6971 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)F 62a_100000183597_100010202630 [0,2,0,0,0,0|1,1,0]=4 6972 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)F 62a_100010202630_100000183597 [0,2,0,0,0,0|1,1,0]=4 6973 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)O 62a_100000183597_100010187914 [0,2,0,0,0,0|1,1,0]=4 6974 B16R1.87 C=CCNC(=O)CSc1cccc(c1Br)O 62a_100010187914_100000183597 [0,2,0,0,0,0|1,1,0]=4 6975 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)Br 62a_100000183597_100012353703 [0,2,0,0,0,0|1,1,0]=4 6976 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)Br 62a_100012353703_100000183597 [0,2,0,0,0,0|1,1,0]=4 6977 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)C 62a_100000183597_100011214922 [0,2,0,0,0,0|1,1,0]=4 6978 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)C 62a_100011214922_100000183597 [0,2,0,0,0,0|1,1,0]=4 6979 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)Cl 62a_100000183597_100000726075 [0,2,0,0,0,0|1,1,0]=4 6980 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)Cl 62a_100000726075_100000183597 [0,2,0,0,0,0|1,1,0]=4 6981 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)F 62a_100000183597_100011216893 [0,2,0,0,0,0|1,1,0]=4 6982 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)F 62a_100011216893_100000183597 [0,2,0,0,0,0|1,1,0]=4 6983 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)N 62a_100000183597_100000761887 [0,2,0,0,0,0|1,1,0]=4 6984 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)N 62a_100000761887_100000183597 [0,2,0,0,0,0|1,1,0]=4 6985 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)O 62a_100000183597_100012002258 [0,2,0,0,0,0|1,1,0]=4 6986 B16R1.87 C=CCNC(=O)CSc1cccc(c1C)O 62a_100012002258_100000183597 [0,2,0,0,0,0|1,1,0]=4 6987 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)Br 62a_100000183597_100010142854 [0,2,0,0,0,0|1,1,0]=4 6988 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)Br 62a_100010142854_100000183597 [0,2,0,0,0,0|1,1,0]=4 6989 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)C 62a_100000183597_200012352035 [0,2,0,0,0,0|1,1,0]=4 6990 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)C 62a_200012352035_100000183597 [0,2,0,0,0,0|1,1,0]=4 6991 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)Cl 62a_100000183597_100011215384 [0,2,0,0,0,0|1,1,0]=4 6992 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)Cl 62a_100011215384_100000183597 [0,2,0,0,0,0|1,1,0]=4 6993 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)F 62a_100000183597_200010234923 [0,2,0,0,0,0|1,1,0]=4 6994 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)F 62a_200010234923_100000183597 [0,2,0,0,0,0|1,1,0]=4 6995 B16R1.87 C=CCNC(=O)CSc1cccc(c1Cl)O 62a_100000183597_100000049636 [0,2,0,0,0,0|1,1,0]=4 6996 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)Br 62a_100000183597_100000702267 [0,2,0,0,0,0|1,1,0]=4 6997 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)Br 62a_100000702267_100000183597 [0,2,0,0,0,0|1,1,0]=4 6998 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)C 62a_100000183597_100000717567 [0,2,0,0,0,0|1,1,0]=4 6999 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)C 62a_100000717567_100000183597 [0,2,0,0,0,0|1,1,0]=4 7000 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)Cl 62a_100000183597_100011217346 [0,2,0,0,0,0|1,1,0]=4 7001 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)Cl 62a_100011217346_100000183597 [0,2,0,0,0,0|1,1,0]=4 7002 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)F 62a_100000183597_100000694657 [0,2,0,0,0,0|1,1,0]=4 7003 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)F 62a_100000694657_100000183597 [0,2,0,0,0,0|1,1,0]=4 7004 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)N 62a_100000183597_100011935091 [0,2,0,0,0,0|1,1,0]=4 7005 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)N 62a_100011935091_100000183597 [0,2,0,0,0,0|1,1,0]=4 7006 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)O 62a_100000183597_100009817021 [0,2,0,0,0,0|1,1,0]=4 7007 B16R1.87 C=CCNC(=O)CSc1cccc(c1F)O 62a_100009817021_100000183597 [0,2,0,0,0,0|1,1,0]=4 7008 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)Br 62a_100000183597_100010146558 [0,2,0,0,0,0|1,1,0]=4 7009 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)Br 62a_100010146558_100000183597 [0,2,0,0,0,0|1,1,0]=4 7010 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)C 62a_100000183597_100011834072 [0,2,0,0,0,0|1,1,0]=4 7011 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)C 62a_100011834072_100000183597 [0,2,0,0,0,0|1,1,0]=4 7012 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)Cl 62a_100000183597_100010190421 [0,2,0,0,0,0|1,1,0]=4 7013 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)Cl 62a_100010190421_100000183597 [0,2,0,0,0,0|1,1,0]=4 7014 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)F 62a_100000042321_100000183597 [0,2,0,0,0,0|1,1,0]=4 7015 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)F 62a_100000183597_100000042321 [0,2,0,0,0,0|1,1,0]=4 7016 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)N 62a_100015191791_100000183597 [0,2,0,0,0,0|1,1,0]=4 7017 B16R1.87 C=CCNC(=O)CSc1cccc(c1N)O 62a_100000183597_100011934926 [0,2,0,0,0,0|1,1,0]=4 7018 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)Br 62a_100000183597_100010084509 [0,2,0,0,0,0|1,1,0]=4 7019 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)Br 62a_100010084509_100000183597 [0,2,0,0,0,0|1,1,0]=4 7020 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)C 62a_100000183597_100009817157 [0,2,0,0,0,0|1,1,0]=4 7021 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)C 62a_100009817157_100000183597 [0,2,0,0,0,0|1,1,0]=4 7022 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)Cl 62a_100000183597_100010202889 [0,2,0,0,0,0|1,1,0]=4 7023 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)Cl 62a_100010202889_100000183597 [0,2,0,0,0,0|1,1,0]=4 7024 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)F 62a_100000183597_100009813666 [0,2,0,0,0,0|1,1,0]=4 7025 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)F 62a_100009813666_100000183597 [0,2,0,0,0,0|1,1,0]=4 7026 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)N 62a_100000183597_100010084371 [0,2,0,0,0,0|1,1,0]=4 7027 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)N 62a_100011934915_100000183597 [0,2,0,0,0,0|1,1,0]=4 7028 B16R1.87 C=CCNC(=O)CSc1cccc(c1O)O 62a_100000183597_100009815950 [0,2,0,0,0,0|1,1,0]=4 7029 B16R1.87 C=CCOC(=O)CNc1cccc(c1Br)C 34a_100000684715_100000033060 [0,2,0,0,0,0|1,0,0]=3 7030 B16R1.87 C=CCOC(=O)CNc1cccc(c1Br)Cl 34a_100000687072_100000033060 [0,2,0,0,0,0|1,0,0]=3 7031 B16R1.87 C=CCOC(=O)CNc1cccc(c1Br)F 34a_100011934729_100000033060 [0,2,0,0,0,0|1,0,0]=3 7032 B16R1.87 C=CCOC(=O)CNc1cccc(c1Br)O 34a_100012183704_100000033060 [0,2,0,0,0,0|1,0,0]=3 7033 B16R1.87 C=CCOC(=O)CNc1cccc(c1Br)O 7a_100012183704_100000033060 [0,2,0,0,0,0|1,0,0]=3 7034 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)Br 34a_100000750434_100000033060 [0,2,0,0,0,0|1,0,0]=3 7035 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)C 2230a_100000210026_100000033060 [0,2,0,0,0,0|1,0,0]=3 7036 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)C 34a_100000210026_100000033060 [0,2,0,0,0,0|1,0,0]=3 7037 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)C 7a_100000210026_100000033060 [0,2,0,0,0,0|1,0,0]=3 7038 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)Cl 2230a_100000210441_100000033060 [0,2,0,0,0,0|1,0,0]=3 7039 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)Cl 34a_100000210441_100000033060 [0,2,0,0,0,0|1,0,0]=3 7040 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)Cl 7a_100000210441_100000033060 [0,2,0,0,0,0|1,0,0]=3 7041 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)F 34a_100000745574_100000033060 [0,2,0,0,0,0|1,0,0]=3 7042 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)F 7a_100000745574_100000033060 [0,2,0,0,0,0|1,0,0]=3 7043 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)I 34a_100000761887_100000033060 [0,2,0,0,0,0|1,0,0]=3 7044 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)O 34a_100011216573_100000033060 [0,2,0,0,0,0|1,0,0]=3 7045 B16R1.87 C=CCOC(=O)CNc1cccc(c1C)O 7a_100011216573_100000033060 [0,2,0,0,0,0|1,0,0]=3 7046 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)Br 34a_100000687075_100000033060 [0,2,0,0,0,0|1,0,0]=3 7047 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)C 34a_100000765562_100000033060 [0,2,0,0,0,0|1,0,0]=3 7048 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)C 7a_100000765562_100000033060 [0,2,0,0,0,0|1,0,0]=3 7049 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)Cl 34a_100000185733_100000033060 [0,2,0,0,0,0|1,0,0]=3 7050 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)F 34a_100000692321_100000033060 [0,2,0,0,0,0|1,0,0]=3 7051 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)O 34a_100012002038_100000033060 [0,2,0,0,0,0|1,0,0]=3 7052 B16R1.87 C=CCOC(=O)CNc1cccc(c1Cl)O 7a_100012002038_100000033060 [0,2,0,0,0,0|1,0,0]=3 7053 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)Br 2230a_100011935091_100000033060 [0,2,0,0,0,0|1,0,0]=3 7054 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)Br 34a_100011935091_100000033060 [0,2,0,0,0,0|1,0,0]=3 7055 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)C 2230a_100000697159_100000033060 [0,2,0,0,0,0|1,0,0]=3 7056 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)C 34a_100000697159_100000033060 [0,2,0,0,0,0|1,0,0]=3 7057 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)C 7a_100000697159_100000033060 [0,2,0,0,0,0|1,0,0]=3 7058 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)Cl 2230a_100000199060_100000033060 [0,2,0,0,0,0|1,0,0]=3 7059 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)Cl 34a_100000199060_100000033060 [0,2,0,0,0,0|1,0,0]=3 7060 B16R1.87 C=CCOC(=O)CNc1cccc(c1F)F 34a_100000743855_100000033060 [0,2,0,0,0,0|1,0,0]=3 7061 B16R1.87 C=CCOC(=O)CNc1cccc(c1I)Br 34a_100020590159_100000033060 [0,2,0,0,0,0|1,0,0]=3 7062 B16R1.87 C=CCOC(=O)CNc1cccc(c1I)C 34a_100000761888_100000033060 [0,2,0,0,0,0|1,0,0]=3 7063 B16R1.87 C=CCOC(=O)CNc1cccc(c1I)Cl 34a_100000049713_100000033060 [0,2,0,0,0,0|1,0,0]=3 7064 B16R1.87 C=CCOC(=O)CNc1cccc(c1I)F 34a_100000690935_100000033060 [0,2,0,0,0,0|1,0,0]=3 7065 B16R1.87 C=CCOC(=O)CNc1cccc(c1O)Br 34a_100011934915_100000033060 [0,2,0,0,0,0|1,0,0]=3 7066 B16R1.87 C=CCOC(=O)CNc1cccc(c1O)C 34a_100000756359_100000033060 [0,2,0,0,0,0|1,0,0]=3 7067 B16R1.87 C=CCOC(=O)CNc1cccc(c1O)Cl 34a_100000754742_100000033060 [0,2,0,0,0,0|1,0,0]=3 7068 B16R1.87 C=CCOC(=O)CNc1cccc(c1O)F 34a_100011934987_100000033060 [0,2,0,0,0,0|1,0,0]=3 7069 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)Br 34a_100010187966_100000033060 [0,2,0,0,0,0|0,0,0]=2 7070 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)Br 7a_100010187966_100000033060 [0,2,0,0,0,0|0,0,0]=2 7071 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)C 34a_100000686692_100000033060 [0,2,0,0,0,0|0,0,0]=2 7072 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)C 7a_100000686692_100000033060 [0,2,0,0,0,0|0,0,0]=2 7073 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)Cl 34a_100012348804_100000033060 [0,2,0,0,0,0|0,0,0]=2 7074 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)Cl 7a_100012348804_100000033060 [0,2,0,0,0,0|0,0,0]=2 7075 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)F 34a_100009820682_100000033060 [0,2,0,0,0,0|0,0,0]=2 7076 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)F 7a_100009820682_100000033060 [0,2,0,0,0,0|0,0,0]=2 7077 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)I 34a_100010187914_100000033060 [0,2,0,0,0,0|0,0,0]=2 7078 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)I 7a_100010187914_100000033060 [0,2,0,0,0,0|0,0,0]=2 7079 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)N 34a_100012183704_100000033060 [0,2,0,0,0,0|0,0,0]=2 7080 B16R1.87 C=CCOC(=O)COc1cccc(c1Br)N 7a_100012183704_100000033060 [0,2,0,0,0,0|0,0,0]=2 7081 B16R1.87 C=CCOC(=O)COc1cccc(c1C)Br 34a_100012002258_100000033060 [0,2,0,0,0,0|0,0,0]=2 7082 B16R1.87 C=CCOC(=O)COc1cccc(c1C)Br 7a_100012002258_100000033060 [0,2,0,0,0,0|0,0,0]=2 7083 B16R1.87 C=CCOC(=O)COc1cccc(c1C)C 34a_100000185855_100000033060 [0,2,0,0,0,0|0,0,0]=2 7084 B16R1.87 C=CCOC(=O)COc1cccc(c1C)C 7a_100000185855_100000033060 [0,2,0,0,0,0|0,0,0]=2 7085 B16R1.87 C=CCOC(=O)COc1cccc(c1C)Cl 34a_100011265684_100000033060 [0,2,0,0,0,0|0,0,0]=2 7086 B16R1.87 C=CCOC(=O)COc1cccc(c1C)Cl 7a_100011265684_100000033060 [0,2,0,0,0,0|0,0,0]=2 7087 B16R1.87 C=CCOC(=O)COc1cccc(c1C)F 34a_100011217231_100000033060 [0,2,0,0,0,0|0,0,0]=2 7088 B16R1.87 C=CCOC(=O)COc1cccc(c1C)F 7a_100011217231_100000033060 [0,2,0,0,0,0|0,0,0]=2 7089 B16R1.87 C=CCOC(=O)COc1cccc(c1C)N 34a_100011216573_100000033060 [0,2,0,0,0,0|0,0,0]=2 7090 B16R1.87 C=CCOC(=O)COc1cccc(c1C)N 7a_100011216573_100000033060 [0,2,0,0,0,0|0,0,0]=2 7091 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)Br 34a_100010187913_100000033060 [0,2,0,0,0,0|0,0,0]=2 7092 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)Br 7a_100010187913_100000033060 [0,2,0,0,0,0|0,0,0]=2 7093 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)C 34a_100000695629_100000033060 [0,2,0,0,0,0|0,0,0]=2 7094 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)C 7a_100000695629_100000033060 [0,2,0,0,0,0|0,0,0]=2 7095 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)Cl 34a_100000211076_100000033060 [0,2,0,0,0,0|0,0,0]=2 7096 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)Cl 7a_100000211076_100000033060 [0,2,0,0,0,0|0,0,0]=2 7097 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)F 34a_100000087408_100000033060 [0,2,0,0,0,0|0,0,0]=2 7098 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)F 7a_100000087408_100000033060 [0,2,0,0,0,0|0,0,0]=2 7099 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)I 34a_100000049636_100000033060 [0,2,0,0,0,0|0,0,0]=2 7100 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)I 7a_100000049636_100000033060 [0,2,0,0,0,0|0,0,0]=2 7101 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)N 34a_100012002038_100000033060 [0,2,0,0,0,0|0,0,0]=2 7102 B16R1.87 C=CCOC(=O)COc1cccc(c1Cl)N 7a_100012002038_100000033060 [0,2,0,0,0,0|0,0,0]=2 7103 B16R1.87 C=CCOC(=O)COc1cccc(c1F)Br 34a_100009817021_100000033060 [0,2,0,0,0,0|0,0,0]=2 7104 B16R1.87 C=CCOC(=O)COc1cccc(c1F)Br 7a_100009817021_100000033060 [0,2,0,0,0,0|0,0,0]=2 7105 B16R1.87 C=CCOC(=O)COc1cccc(c1F)C 34a_100000751311_100000033060 [0,2,0,0,0,0|0,0,0]=2 7106 B16R1.87 C=CCOC(=O)COc1cccc(c1F)C 7a_100000751311_100000033060 [0,2,0,0,0,0|0,0,0]=2 7107 B16R1.87 C=CCOC(=O)COc1cccc(c1F)Cl 34a_100000687438_100000033060 [0,2,0,0,0,0|0,0,0]=2 7108 B16R1.87 C=CCOC(=O)COc1cccc(c1F)Cl 7a_100000687438_100000033060 [0,2,0,0,0,0|0,0,0]=2 7109 B16R1.87 C=CCOC(=O)COc1cccc(c1F)F 34a_100000751161_100000033060 [0,2,0,0,0,0|0,0,0]=2 7110 B16R1.87 C=CCOC(=O)COc1cccc(c1F)F 7a_100000751161_100000033060 [0,2,0,0,0,0|0,0,0]=2 7111 B16R1.87 C=CCOC(=O)COc1cccc(c1I)Br 34a_100010187912_100000033060 [0,2,0,0,0,0|0,0,0]=2 7112 B16R1.87 C=CCOC(=O)COc1cccc(c1I)Br 7a_100010187912_100000033060 [0,2,0,0,0,0|0,0,0]=2 7113 B16R1.87 C=CCOC(=O)COc1cccc(c1I)C 34a_100010083724_100000033060 [0,2,0,0,0,0|0,0,0]=2 7114 B16R1.87 C=CCOC(=O)COc1cccc(c1I)C 7a_100010083724_100000033060 [0,2,0,0,0,0|0,0,0]=2 7115 B16R1.87 C=CCOC(=O)COc1cccc(c1I)Cl 34a_100000050174_100000033060 [0,2,0,0,0,0|0,0,0]=2 7116 B16R1.87 C=CCOC(=O)COc1cccc(c1I)Cl 7a_100000050174_100000033060 [0,2,0,0,0,0|0,0,0]=2 7117 B16R1.87 C=CCOC(=O)COc1cccc(c1I)F 34a_100000690913_100000033060 [0,2,0,0,0,0|0,0,0]=2 7118 B16R1.87 C=CCOC(=O)COc1cccc(c1I)F 7a_100000690913_100000033060 [0,2,0,0,0,0|0,0,0]=2 7119 B16R1.87 C=CCOC(=O)COc1cccc(c1N)Br 34a_100011934926_100000033060 [0,2,0,0,0,0|0,0,0]=2 7120 B16R1.87 C=CCOC(=O)COc1cccc(c1N)Br 7a_100011934926_100000033060 [0,2,0,0,0,0|0,0,0]=2 7121 B16R1.87 C=CCOC(=O)COc1cccc(c1N)C 34a_100000743429_100000033060 [0,2,0,0,0,0|0,0,0]=2 7122 B16R1.87 C=CCOC(=O)COc1cccc(c1N)C 7a_100000743429_100000033060 [0,2,0,0,0,0|0,0,0]=2 7123 B16R1.87 C=CCOC(=O)COc1cccc(c1N)Cl 34a_100012022510_100000033060 [0,2,0,0,0,0|0,0,0]=2 7124 B16R1.87 C=CCOC(=O)COc1cccc(c1N)Cl 7a_100012022510_100000033060 [0,2,0,0,0,0|0,0,0]=2 7125 B16R1.87 C=CCOC(=O)COc1cccc(c1N)F 34a_100020591140_100000033060 [0,2,0,0,0,0|0,0,0]=2 7126 B16R1.87 C=CCOC(=O)COc1cccc(c1N)F 7a_100020591140_100000033060 [0,2,0,0,0,0|0,0,0]=2 7127 B16R1.87 C=CCOC(=O)COc1cccc(c1N)I 34a_200000049512_100000033060 [0,2,0,0,0,0|0,0,0]=2 7128 B16R1.87 C=CCOC(=O)COc1cccc(c1N)I 7a_200000049512_100000033060 [0,2,0,0,0,0|0,0,0]=2 7129 B16R1.87 C=CCOC(=O)COc1cccc(c1N)N 34a_100000033209_100000033060 [0,2,0,0,0,0|0,0,0]=2 7130 B16R1.87 C=CCOC(=O)COc1cccn(c1=O)C 34a_100000117616_100000033060 [0,2,0,0,0,0|1,0,0]=3 7131 B16R1.87 C=CCOC(=O)COc1cccn(c1=O)C 7a_100000117616_100000033060 [0,2,0,0,0,0|1,0,0]=3 7132 B16R1.87 C=CCOC(=O)COc1ccnc(c1Br)Cl 34a_100010136240_100000033060 [0,2,0,0,0,0|1,0,0]=3 7133 B16R1.87 C=CCOC(=O)COc1ccnc(c1Cl)Cl 34a_100009860235_100000033060 [0,2,0,0,0,0|1,0,0]=3 7134 B16R1.87 C=CCOC(=O)COc1ccnc(c1F)Br 34a_100009876375_100000033060 [0,2,0,0,0,0|1,0,0]=3 7135 B16R1.87 C=CCOC(=O)COc1ccnc(c1F)Cl 34a_100009856406_100000033060 [0,2,0,0,0,0|1,0,0]=3 7136 B16R1.87 C=CCOC(=O)COc1ccnc(c1N)Cl 34a_100000128729_100000033060 [0,2,0,0,0,0|1,0,0]=3 7137 B16R1.87 C=CCOC(=O)COc1nccc(c1Br)C 34a_100012000493_100000033060 [0,2,0,0,0,0|1,0,0]=3 7138 B16R1.87 C=CCOC(=O)COc1nccc(c1C)Br 34a_100009858498_100000033060 [0,2,0,0,0,0|1,0,0]=3 7139 B16R1.87 C=CCOC(=O)COc1nccc(c1Cl)N 34a_200000093555_100000033060 [0,2,0,0,0,0|1,0,0]=3 7140 B16R1.87 C=CCOC(=O)COc1ncnc(c1C)C 34a_100000697798_100000033060 [0,2,0,0,0,0|2,0,0]=4 7141 B16R1.87 C=CCOC(=O)COc1ncnc(c1C)Cl 34a_100011912821_100000033060 [0,2,0,0,0,0|2,0,0]=4 7142 B16R1.87 C=CCOC(=O)CSc1cccc(=O)n1C 62a_100000033060_100000726605 [0,2,0,0,0,0|1,1,0]=4 7143 B16R1.87 C=CCOC(=O)CSc1cccc(=O)n1C 62a_100000726605_100000033060 [0,2,0,0,0,0|1,1,0]=4 7144 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)Br 62a_100000033060_100010175083 [0,2,0,0,0,0|0,1,0]=3 7145 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)Br 62a_100010175083_100000033060 [0,2,0,0,0,0|0,1,0]=3 7146 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)C 62a_100000033060_100012362457 [0,2,0,0,0,0|0,1,0]=3 7147 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)C 62a_100012362457_100000033060 [0,2,0,0,0,0|0,1,0]=3 7148 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)Cl 62a_100000033060_100014021842 [0,2,0,0,0,0|0,1,0]=3 7149 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)Cl 62a_100014021842_100000033060 [0,2,0,0,0,0|0,1,0]=3 7150 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)F 62a_100000033060_100010202630 [0,2,0,0,0,0|0,1,0]=3 7151 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)F 62a_100010202630_100000033060 [0,2,0,0,0,0|0,1,0]=3 7152 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)O 62a_100000033060_100010187914 [0,2,0,0,0,0|0,1,0]=3 7153 B16R1.87 C=CCOC(=O)CSc1cccc(c1Br)O 62a_100010187914_100000033060 [0,2,0,0,0,0|0,1,0]=3 7154 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)Br 62a_100000033060_100012353703 [0,2,0,0,0,0|0,1,0]=3 7155 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)Br 62a_100012353703_100000033060 [0,2,0,0,0,0|0,1,0]=3 7156 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)C 62a_100000033060_100011214922 [0,2,0,0,0,0|0,1,0]=3 7157 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)C 62a_100011214922_100000033060 [0,2,0,0,0,0|0,1,0]=3 7158 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)Cl 62a_100000033060_100000726075 [0,2,0,0,0,0|0,1,0]=3 7159 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)Cl 62a_100000726075_100000033060 [0,2,0,0,0,0|0,1,0]=3 7160 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)F 62a_100000033060_100011216893 [0,2,0,0,0,0|0,1,0]=3 7161 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)F 62a_100011216893_100000033060 [0,2,0,0,0,0|0,1,0]=3 7162 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)N 62a_100000033060_100000761887 [0,2,0,0,0,0|0,1,0]=3 7163 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)N 62a_100000761887_100000033060 [0,2,0,0,0,0|0,1,0]=3 7164 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)O 62a_100000033060_100012002258 [0,2,0,0,0,0|0,1,0]=3 7165 B16R1.87 C=CCOC(=O)CSc1cccc(c1C)O 62a_100012002258_100000033060 [0,2,0,0,0,0|0,1,0]=3 7166 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)Br 62a_100000033060_100010142854 [0,2,0,0,0,0|0,1,0]=3 7167 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)Br 62a_100010142854_100000033060 [0,2,0,0,0,0|0,1,0]=3 7168 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)C 62a_100000033060_200012352035 [0,2,0,0,0,0|0,1,0]=3 7169 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)C 62a_200012352035_100000033060 [0,2,0,0,0,0|0,1,0]=3 7170 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)Cl 62a_100000033060_100011215384 [0,2,0,0,0,0|0,1,0]=3 7171 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)Cl 62a_100011215384_100000033060 [0,2,0,0,0,0|0,1,0]=3 7172 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)F 62a_100000033060_200010234923 [0,2,0,0,0,0|0,1,0]=3 7173 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)F 62a_200010234923_100000033060 [0,2,0,0,0,0|0,1,0]=3 7174 B16R1.87 C=CCOC(=O)CSc1cccc(c1Cl)O 62a_100000033060_100000049636 [0,2,0,0,0,0|0,1,0]=3 7175 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)Br 62a_100000033060_100000702267 [0,2,0,0,0,0|0,1,0]=3 7176 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)Br 62a_100000702267_100000033060 [0,2,0,0,0,0|0,1,0]=3 7177 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)C 62a_100000033060_100000717567 [0,2,0,0,0,0|0,1,0]=3 7178 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)C 62a_100000717567_100000033060 [0,2,0,0,0,0|0,1,0]=3 7179 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)Cl 62a_100000033060_100011217346 [0,2,0,0,0,0|0,1,0]=3 7180 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)Cl 62a_100011217346_100000033060 [0,2,0,0,0,0|0,1,0]=3 7181 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)F 62a_100000033060_100000694657 [0,2,0,0,0,0|0,1,0]=3 7182 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)F 62a_100000694657_100000033060 [0,2,0,0,0,0|0,1,0]=3 7183 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)N 62a_100000033060_100011935091 [0,2,0,0,0,0|0,1,0]=3 7184 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)N 62a_100011935091_100000033060 [0,2,0,0,0,0|0,1,0]=3 7185 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)O 62a_100000033060_100009817021 [0,2,0,0,0,0|0,1,0]=3 7186 B16R1.87 C=CCOC(=O)CSc1cccc(c1F)O 62a_100009817021_100000033060 [0,2,0,0,0,0|0,1,0]=3 7187 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)Br 62a_100000033060_100010146558 [0,2,0,0,0,0|0,1,0]=3 7188 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)Br 62a_100010146558_100000033060 [0,2,0,0,0,0|0,1,0]=3 7189 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)C 62a_100000033060_100011834072 [0,2,0,0,0,0|0,1,0]=3 7190 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)C 62a_100011834072_100000033060 [0,2,0,0,0,0|0,1,0]=3 7191 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)Cl 62a_100000033060_100010190421 [0,2,0,0,0,0|0,1,0]=3 7192 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)Cl 62a_100010190421_100000033060 [0,2,0,0,0,0|0,1,0]=3 7193 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)F 62a_100000033060_100000042321 [0,2,0,0,0,0|0,1,0]=3 7194 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)F 62a_100000042321_100000033060 [0,2,0,0,0,0|0,1,0]=3 7195 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)N 62a_100015191791_100000033060 [0,2,0,0,0,0|0,1,0]=3 7196 B16R1.87 C=CCOC(=O)CSc1cccc(c1N)O 62a_100000033060_100011934926 [0,2,0,0,0,0|0,1,0]=3 7197 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)Br 62a_100000033060_100010084509 [0,2,0,0,0,0|0,1,0]=3 7198 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)Br 62a_100010084509_100000033060 [0,2,0,0,0,0|0,1,0]=3 7199 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)C 62a_100000033060_100009817157 [0,2,0,0,0,0|0,1,0]=3 7200 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)C 62a_100009817157_100000033060 [0,2,0,0,0,0|0,1,0]=3 7201 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)Cl 62a_100000033060_100010202889 [0,2,0,0,0,0|0,1,0]=3 7202 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)Cl 62a_100010202889_100000033060 [0,2,0,0,0,0|0,1,0]=3 7203 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)F 62a_100000033060_100009813666 [0,2,0,0,0,0|0,1,0]=3 7204 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)F 62a_100009813666_100000033060 [0,2,0,0,0,0|0,1,0]=3 7205 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)N 62a_100000033060_100010084371 [0,2,0,0,0,0|0,1,0]=3 7206 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)N 62a_100011934915_100000033060 [0,2,0,0,0,0|0,1,0]=3 7207 B16R1.87 C=CCOC(=O)CSc1cccc(c1O)O 62a_100000033060_100009815950 [0,2,0,0,0,0|0,1,0]=3 7208 B16R1.87 C=CCOC(=O)CSc1cccn(c1=O)C 62a_100000033060_100000687173 [0,2,0,0,0,0|1,1,0]=4 7209 B16R1.87 C=CCOC(=O)CSc1cccn(c1=O)C 62a_100000687173_100000033060 [0,2,0,0,0,0|1,1,0]=4 7210 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Br)F 62a_100000033060_100010006599 [0,2,0,0,0,0|1,1,0]=4 7211 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Br)F 62a_100010006599_100000033060 [0,2,0,0,0,0|1,1,0]=4 7212 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)C 62a_100000033060_100009846815 [0,2,0,0,0,0|1,1,0]=4 7213 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)C 62a_100009846815_100000033060 [0,2,0,0,0,0|1,1,0]=4 7214 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)Cl 62a_100000033060_100000047055 [0,2,0,0,0,0|1,1,0]=4 7215 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)Cl 62a_100000047055_100000033060 [0,2,0,0,0,0|1,1,0]=4 7216 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)F 62a_100000033060_100010006593 [0,2,0,0,0,0|1,1,0]=4 7217 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)F 62a_100010006593_100000033060 [0,2,0,0,0,0|1,1,0]=4 7218 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)N 62a_100000033060_100009865460 [0,2,0,0,0,0|1,1,0]=4 7219 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)N 62a_100009865460_100000033060 [0,2,0,0,0,0|1,1,0]=4 7220 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)O 62a_100000033060_100009858498 [0,2,0,0,0,0|1,1,0]=4 7221 B16R1.87 C=CCOC(=O)CSc1ccnc(c1C)O 62a_100009858498_100000033060 [0,2,0,0,0,0|1,1,0]=4 7222 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)C 62a_100000033060_100000698670 [0,2,0,0,0,0|1,1,0]=4 7223 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)C 62a_100000698670_100000033060 [0,2,0,0,0,0|1,1,0]=4 7224 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)Cl 62a_100000033060_100010246212 [0,2,0,0,0,0|1,1,0]=4 7225 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)Cl 62a_100010246212_100000033060 [0,2,0,0,0,0|1,1,0]=4 7226 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)F 62a_100000033060_100010067886 [0,2,0,0,0,0|1,1,0]=4 7227 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)F 62a_100010067886_100000033060 [0,2,0,0,0,0|1,1,0]=4 7228 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)N 62a_100000033060_100010735111 [0,2,0,0,0,0|1,1,0]=4 7229 B16R1.87 C=CCOC(=O)CSc1ccnc(c1Cl)N 62a_100010735111_100000033060 [0,2,0,0,0,0|1,1,0]=4 7230 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)Br 62a_100000033060_200015269031 [0,2,0,0,0,0|1,1,0]=4 7231 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)Br 62a_200015269031_100000033060 [0,2,0,0,0,0|1,1,0]=4 7232 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)C 62a_100000033060_100009849794 [0,2,0,0,0,0|1,1,0]=4 7233 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)C 62a_100009849794_100000033060 [0,2,0,0,0,0|1,1,0]=4 7234 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)Cl 62a_100000033060_100010150473 [0,2,0,0,0,0|1,1,0]=4 7235 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)Cl 62a_100010150473_100000033060 [0,2,0,0,0,0|1,1,0]=4 7236 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)F 62a_100000033060_100010214882 [0,2,0,0,0,0|1,1,0]=4 7237 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)F 62a_100010214882_100000033060 [0,2,0,0,0,0|1,1,0]=4 7238 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)N 62a_100000033060_100010077785 [0,2,0,0,0,0|1,1,0]=4 7239 B16R1.87 C=CCOC(=O)CSc1ccnc(c1F)N 62a_100010077785_100000033060 [0,2,0,0,0,0|1,1,0]=4 7240 B16R1.87 C=CCOC(=O)CSc1ccnc(c1N)C 62a_100000033060_100009885578 [0,2,0,0,0,0|1,1,0]=4 7241 B16R1.87 C=CCOC(=O)CSc1ccnc(c1N)C 62a_100009885578_100000033060 [0,2,0,0,0,0|1,1,0]=4 7242 B16R1.87 C=CCOC(=O)CSc1ccnc(c1N)N 62a_100000124095_100000033060 [0,2,0,0,0,0|1,1,0]=4 7243 B16R1.87 C=CCOC(=O)CSc1ccnc(c1O)Cl 62a_100000033060_100010067911 [0,2,0,0,0,0|1,1,0]=4 7244 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)Br 62a_100000033060_100010109657 [0,2,0,0,0,0|1,1,0]=4 7245 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)Br 62a_100010109657_100000033060 [0,2,0,0,0,0|1,1,0]=4 7246 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)C 62a_100000033060_100009864703 [0,2,0,0,0,0|1,1,0]=4 7247 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)C 62a_100009864703_100000033060 [0,2,0,0,0,0|1,1,0]=4 7248 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)F 62a_100000033060_100009881546 [0,2,0,0,0,0|1,1,0]=4 7249 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)F 62a_100009881546_100000033060 [0,2,0,0,0,0|1,1,0]=4 7250 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)N 62a_100000033060_100011998293 [0,2,0,0,0,0|1,1,0]=4 7251 B16R1.87 C=CCOC(=O)CSc1cncc(c1C)N 62a_100011998293_100000033060 [0,2,0,0,0,0|1,1,0]=4 7252 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)Br 62a_100000033060_100011290786 [0,2,0,0,0,0|1,1,0]=4 7253 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)Br 62a_100011290786_100000033060 [0,2,0,0,0,0|1,1,0]=4 7254 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)C 62a_100000033060_100009818025 [0,2,0,0,0,0|1,1,0]=4 7255 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)C 62a_100009818025_100000033060 [0,2,0,0,0,0|1,1,0]=4 7256 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)Cl 62a_100000033060_100000684942 [0,2,0,0,0,0|1,1,0]=4 7257 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)Cl 62a_100000684942_100000033060 [0,2,0,0,0,0|1,1,0]=4 7258 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)F 62a_100000033060_100009880649 [0,2,0,0,0,0|1,1,0]=4 7259 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)F 62a_100009880649_100000033060 [0,2,0,0,0,0|1,1,0]=4 7260 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)N 62a_100000033060_100000694774 [0,2,0,0,0,0|1,1,0]=4 7261 B16R1.87 C=CCOC(=O)CSc1cncc(c1N)N 62a_100000694774_100000033060 [0,2,0,0,0,0|1,1,0]=4 7262 B16R1.87 C=CCOC(=O)CSc1cncc(c1O)N 62a_100000033060_100000694263 [0,2,0,0,0,0|1,1,0]=4 7263 B16R1.87 C=CCOC(=O)CSc1cncc(c1O)N 62a_100000694263_100000033060 [0,2,0,0,0,0|1,1,0]=4 7264 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)C 62a_100000033060_100009847204 [0,2,0,0,0,0|1,1,0]=4 7265 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)C 62a_100009847204_100000033060 [0,2,0,0,0,0|1,1,0]=4 7266 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)F 62a_100000033060_100009846374 [0,2,0,0,0,0|1,1,0]=4 7267 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)F 62a_100009846374_100000033060 [0,2,0,0,0,0|1,1,0]=4 7268 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)N 62a_100000033060_100000690622 [0,2,0,0,0,0|1,1,0]=4 7269 B16R1.87 C=CCOC(=O)CSc1nccc(c1C)N 62a_100000690622_100000033060 [0,2,0,0,0,0|1,1,0]=4 7270 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)C 62a_100000033060_100009817629 [0,2,0,0,0,0|1,1,0]=4 7271 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)C 62a_100009817629_100000033060 [0,2,0,0,0,0|1,1,0]=4 7272 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)N 62a_100000033060_100015205195 [0,2,0,0,0,0|1,1,0]=4 7273 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)N 62a_100015205195_100000033060 [0,2,0,0,0,0|1,1,0]=4 7274 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)O 62a_100000033060_100009876375 [0,2,0,0,0,0|1,1,0]=4 7275 B16R1.87 C=CCOC(=O)CSc1nccc(c1F)O 62a_100009876375_100000033060 [0,2,0,0,0,0|1,1,0]=4 7276 B16R1.87 C=CCOC(=O)CSc1nccc(c1N)C 62a_100000033060_100000763560 [0,2,0,0,0,0|1,1,0]=4 7277 B16R1.87 C=CCOC(=O)CSc1nccc(c1N)C 62a_100000763560_100000033060 [0,2,0,0,0,0|1,1,0]=4 7278 B16R1.87 C=CCOC(=O)CSc1nccc(c1N)N 62a_100000033060_100000085203 [0,2,0,0,0,0|1,1,0]=4 7279 B16R1.87 C=CCOC(=O)CSc1nccc(c1N)N 62a_100000085203_100000033060 [0,2,0,0,0,0|1,1,0]=4 7280 B16R1.87 C=CCOC(=O)CSc1nccc(c1O)C 62a_100000033060_100000696282 [0,2,0,0,0,0|1,1,0]=4 7281 B16R1.87 C=CCOC(=O)CSc1nccc(c1O)F 62a_100000033060_100009867227 [0,2,0,0,0,0|1,1,0]=4 7282 B16R1.87 C=CCOC(=O)CSc1nccc(c1O)N 62a_100000033060_100009844647 [0,2,0,0,0,0|1,1,0]=4 7283 B16R1.87 CCCOC(=O)COc1cccc(c1Br)Br 34a_100010187966_200011215008 [0,2,0,0,0,0|0,0,2]=4 7284 B16R1.87 CCCOC(=O)COc1cccc(c1Br)Br 7a_100010187966_200011215008 [0,2,0,0,0,0|0,0,2]=4 7285 B16R1.87 CCCOC(=O)COc1cccc(c1Br)C 34a_100000686692_200011215008 [0,2,0,0,0,0|0,0,2]=4 7286 B16R1.87 CCCOC(=O)COc1cccc(c1Br)C 7a_100000686692_200011215008 [0,2,0,0,0,0|0,0,2]=4 7287 B16R1.87 CCCOC(=O)COc1cccc(c1Br)Cl 34a_100012348804_200011215008 [0,2,0,0,0,0|0,0,2]=4 7288 B16R1.87 CCCOC(=O)COc1cccc(c1Br)Cl 7a_100012348804_200011215008 [0,2,0,0,0,0|0,0,2]=4 7289 B16R1.87 CCCOC(=O)COc1cccc(c1Br)F 34a_100009820682_200011215008 [0,2,0,0,0,0|0,0,2]=4 7290 B16R1.87 CCCOC(=O)COc1cccc(c1Br)F 7a_100009820682_200011215008 [0,2,0,0,0,0|0,0,2]=4 7291 B16R1.87 CCCOC(=O)COc1cccc(c1Br)I 34a_100010187914_200011215008 [0,2,0,0,0,0|0,0,2]=4 7292 B16R1.87 CCCOC(=O)COc1cccc(c1Br)I 7a_100010187914_200011215008 [0,2,0,0,0,0|0,0,2]=4 7293 B16R1.87 CCCOC(=O)COc1cccc(c1Br)N 34a_100012183704_200011215008 [0,2,0,0,0,0|0,0,2]=4 7294 B16R1.87 CCCOC(=O)COc1cccc(c1Br)N 7a_100012183704_200011215008 [0,2,0,0,0,0|0,0,2]=4 7295 B16R1.87 CCCOC(=O)COc1cccc(c1C)Br 34a_100012002258_200011215008 [0,2,0,0,0,0|0,0,2]=4 7296 B16R1.87 CCCOC(=O)COc1cccc(c1C)Br 7a_100012002258_200011215008 [0,2,0,0,0,0|0,0,2]=4 7297 B16R1.87 CCCOC(=O)COc1cccc(c1C)C 34a_100000185855_200011215008 [0,2,0,0,0,0|0,0,2]=4 7298 B16R1.87 CCCOC(=O)COc1cccc(c1C)C 7a_100000185855_200011215008 [0,2,0,0,0,0|0,0,2]=4 7299 B16R1.87 CCCOC(=O)COc1cccc(c1C)Cl 34a_100011265684_200011215008 [0,2,0,0,0,0|0,0,2]=4 7300 B16R1.87 CCCOC(=O)COc1cccc(c1C)Cl 7a_100011265684_200011215008 [0,2,0,0,0,0|0,0,2]=4 7301 B16R1.87 CCCOC(=O)COc1cccc(c1C)F 34a_100011217231_200011215008 [0,2,0,0,0,0|0,0,2]=4 7302 B16R1.87 CCCOC(=O)COc1cccc(c1C)F 7a_100011217231_200011215008 [0,2,0,0,0,0|0,0,2]=4 7303 B16R1.87 CCCOC(=O)COc1cccc(c1C)N 34a_100011216573_200011215008 [0,2,0,0,0,0|0,0,2]=4 7304 B16R1.87 CCCOC(=O)COc1cccc(c1C)N 7a_100011216573_200011215008 [0,2,0,0,0,0|0,0,2]=4 7305 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)Br 34a_100010187913_200011215008 [0,2,0,0,0,0|0,0,2]=4 7306 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)Br 7a_100010187913_200011215008 [0,2,0,0,0,0|0,0,2]=4 7307 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)C 34a_100000695629_200011215008 [0,2,0,0,0,0|0,0,2]=4 7308 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)C 7a_100000695629_200011215008 [0,2,0,0,0,0|0,0,2]=4 7309 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)Cl 34a_100000211076_200011215008 [0,2,0,0,0,0|0,0,2]=4 7310 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)Cl 7a_100000211076_200011215008 [0,2,0,0,0,0|0,0,2]=4 7311 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)F 34a_100000087408_200011215008 [0,2,0,0,0,0|0,0,2]=4 7312 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)F 7a_100000087408_200011215008 [0,2,0,0,0,0|0,0,2]=4 7313 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)I 34a_100000049636_200011215008 [0,2,0,0,0,0|0,0,2]=4 7314 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)I 7a_100000049636_200011215008 [0,2,0,0,0,0|0,0,2]=4 7315 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)N 34a_100012002038_200011215008 [0,2,0,0,0,0|0,0,2]=4 7316 B16R1.87 CCCOC(=O)COc1cccc(c1Cl)N 7a_100012002038_200011215008 [0,2,0,0,0,0|0,0,2]=4 7317 B16R1.87 CCCOC(=O)COc1cccc(c1F)Br 34a_100009817021_200011215008 [0,2,0,0,0,0|0,0,2]=4 7318 B16R1.87 CCCOC(=O)COc1cccc(c1F)Br 7a_100009817021_200011215008 [0,2,0,0,0,0|0,0,2]=4 7319 B16R1.87 CCCOC(=O)COc1cccc(c1F)C 34a_100000751311_200011215008 [0,2,0,0,0,0|0,0,2]=4 7320 B16R1.87 CCCOC(=O)COc1cccc(c1F)C 7a_100000751311_200011215008 [0,2,0,0,0,0|0,0,2]=4 7321 B16R1.87 CCCOC(=O)COc1cccc(c1F)Cl 34a_100000687438_200011215008 [0,2,0,0,0,0|0,0,2]=4 7322 B16R1.87 CCCOC(=O)COc1cccc(c1F)Cl 7a_100000687438_200011215008 [0,2,0,0,0,0|0,0,2]=4 7323 B16R1.87 CCCOC(=O)COc1cccc(c1F)F 34a_100000751161_200011215008 [0,2,0,0,0,0|0,0,2]=4 7324 B16R1.87 CCCOC(=O)COc1cccc(c1F)F 7a_100000751161_200011215008 [0,2,0,0,0,0|0,0,2]=4 7325 B16R1.87 CCCOC(=O)COc1cccc(c1I)Br 34a_100010187912_200011215008 [0,2,0,0,0,0|0,0,2]=4 7326 B16R1.87 CCCOC(=O)COc1cccc(c1I)Br 7a_100010187912_200011215008 [0,2,0,0,0,0|0,0,2]=4 7327 B16R1.87 CCCOC(=O)COc1cccc(c1I)C 34a_100010083724_200011215008 [0,2,0,0,0,0|0,0,2]=4 7328 B16R1.87 CCCOC(=O)COc1cccc(c1I)C 7a_100010083724_200011215008 [0,2,0,0,0,0|0,0,2]=4 7329 B16R1.87 CCCOC(=O)COc1cccc(c1I)Cl 34a_100000050174_200011215008 [0,2,0,0,0,0|0,0,2]=4 7330 B16R1.87 CCCOC(=O)COc1cccc(c1I)Cl 7a_100000050174_200011215008 [0,2,0,0,0,0|0,0,2]=4 7331 B16R1.87 CCCOC(=O)COc1cccc(c1I)F 34a_100000690913_200011215008 [0,2,0,0,0,0|0,0,2]=4 7332 B16R1.87 CCCOC(=O)COc1cccc(c1I)F 7a_100000690913_200011215008 [0,2,0,0,0,0|0,0,2]=4 7333 B16R1.87 CCCOC(=O)COc1cccc(c1N)Br 34a_100011934926_200011215008 [0,2,0,0,0,0|0,0,2]=4 7334 B16R1.87 CCCOC(=O)COc1cccc(c1N)Br 7a_100011934926_200011215008 [0,2,0,0,0,0|0,0,2]=4 7335 B16R1.87 CCCOC(=O)COc1cccc(c1N)C 34a_100000743429_200011215008 [0,2,0,0,0,0|0,0,2]=4 7336 B16R1.87 CCCOC(=O)COc1cccc(c1N)C 7a_100000743429_200011215008 [0,2,0,0,0,0|0,0,2]=4 7337 B16R1.87 CCCOC(=O)COc1cccc(c1N)Cl 34a_100012022510_200011215008 [0,2,0,0,0,0|0,0,2]=4 7338 B16R1.87 CCCOC(=O)COc1cccc(c1N)Cl 7a_100012022510_200011215008 [0,2,0,0,0,0|0,0,2]=4 7339 B16R1.87 CCCOC(=O)COc1cccc(c1N)F 34a_100020591140_200011215008 [0,2,0,0,0,0|0,0,2]=4 7340 B16R1.87 CCCOC(=O)COc1cccc(c1N)F 7a_100020591140_200011215008 [0,2,0,0,0,0|0,0,2]=4 7341 B16R1.87 CCCOC(=O)COc1cccc(c1N)I 34a_200000049512_200011215008 [0,2,0,0,0,0|0,0,2]=4 7342 B16R1.87 CCCOC(=O)COc1cccc(c1N)I 7a_200000049512_200011215008 [0,2,0,0,0,0|0,0,2]=4 7343 B16R1.87 CCCOC(=O)COc1cccc(c1N)N 34a_100000033209_200011215008 [0,2,0,0,0,0|0,0,2]=4 7344 B16R1.659 C=CCCC(=O)C(C)Oc1cccc(c1)Br 1458a_100000246016_100000754431 [0,2,0,0,0,0|1,0,0]=3 7345 B16R1.659 C=CCCC(=O)C(C)Oc1cccc(c1)C 1458a_100000183885_100000754431 [0,2,0,0,0,0|1,0,0]=3 7346 B16R1.659 C=CCCC(=O)C(C)Oc1cccc(c1)Cl 1458a_100000185161_100000754431 [0,2,0,0,0,0|1,0,0]=3 7347 B16R1.659 C=CCCC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_100000754431 [0,2,0,0,0,0|2,0,0]=4 7348 B16R1.659 C=CCCC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_100000754431 [0,2,0,0,0,0|2,0,0]=4 7349 B16R1.659 C=CCNC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100000230288 [0,2,0,0,0,0|2,0,0]=4 7350 B16R1.659 C=CCNC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000230288 [0,2,0,0,0,0|2,0,0]=4 7351 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Br 1626a_100020586998_100000246016 [0,2,0,0,0,0|1,0,0]=3 7352 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Br 240690a_100020586998_100000246016 [0,2,0,0,0,0|1,0,0]=3 7353 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Br 527a_100020586998_100000246016 [0,2,0,0,0,0|1,0,0]=3 7354 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000230288 [0,2,0,0,0,0|1,0,0]=3 7355 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)C 1626a_100020586998_100000183885 [0,2,0,0,0,0|1,0,0]=3 7356 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)C 240690a_100020586998_100000183885 [0,2,0,0,0,0|1,0,0]=3 7357 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)C 527a_100020586998_100000183885 [0,2,0,0,0,0|1,0,0]=3 7358 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000230288 [0,2,0,0,0,0|1,0,0]=3 7359 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Cl 1626a_100020586998_100000185161 [0,2,0,0,0,0|1,0,0]=3 7360 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Cl 240690a_100020586998_100000185161 [0,2,0,0,0,0|1,0,0]=3 7361 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Cl 527a_100020586998_100000185161 [0,2,0,0,0,0|1,0,0]=3 7362 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000230288 [0,2,0,0,0,0|1,0,0]=3 7363 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000230288 [0,2,0,0,0,0|1,0,0]=3 7364 B16R1.659 C=CCNC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000230288 [0,2,0,0,0,0|1,0,0]=3 7365 B16R1.659 C=CCNC(=O)C(C)Oc1cncc(c1)Br 7a_100000754920_100000230288 [0,2,0,0,0,0|2,0,0]=4 7366 B16R1.659 C=CCNC(=O)C(C)Oc1cncc(c1)C 7a_100011830280_100000230288 [0,2,0,0,0,0|2,0,0]=4 7367 B16R1.659 C=CCNC(=O)C(C)Oc1cncc(c1)Cl 7a_100000032511_100000230288 [0,2,0,0,0,0|2,0,0]=4 7368 B16R1.659 C=CCNC(=O)C(C)Oc1cncc(c1)F 7a_100011830296_100000230288 [0,2,0,0,0,0|2,0,0]=4 7369 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)Br 62a_100000230288_100000691529 [0,2,0,0,0,0|1,1,0]=4 7370 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100000230288 [0,2,0,0,0,0|1,1,0]=4 7371 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)C 62a_100000230288_100011215228 [0,2,0,0,0,0|1,1,0]=4 7372 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100000230288 [0,2,0,0,0,0|1,1,0]=4 7373 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)Cl 62a_100000230288_100000699651 [0,2,0,0,0,0|1,1,0]=4 7374 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100000230288 [0,2,0,0,0,0|1,1,0]=4 7375 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)F 62a_100000230288_100000685547 [0,2,0,0,0,0|1,1,0]=4 7376 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100000230288 [0,2,0,0,0,0|1,1,0]=4 7377 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100000230288 [0,2,0,0,0,0|1,1,0]=4 7378 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)N 62a_100000230288_100000210019 [0,2,0,0,0,0|1,1,0]=4 7379 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)O 62a_100000230288_100000211634 [0,2,0,0,0,0|1,1,0]=4 7380 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)[S] 62a_100000230288_114929384022 [0,2,0,0,0,0|1,1,0]=4 7381 B16R1.659 C=CCNC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100000230288 [0,2,0,0,0,0|1,1,0]=4 7382 B16R1.659 C=CCNC(=O)C(O)Cc1cccc(c1)Br 240690a_100020586998_100012362086 [0,2,0,0,0,0|2,0,0]=4 7383 B16R1.659 C=CCNC(=O)[C@@H](O)Cc1cccc(c1)F 240690a_100020586998_200016142683 [0,2,0,0,0,0|2,0,0]=4 7384 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)Br 34a_100000210342_100000760410 [0,2,0,0,0,0|0,0,2]=4 7385 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000760410 [0,2,0,0,0,0|0,0,2]=4 7386 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)C 34a_100000210337_100000760410 [0,2,0,0,0,0|0,0,2]=4 7387 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000760410 [0,2,0,0,0,0|0,0,2]=4 7388 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)Cl 34a_100000210295_100000760410 [0,2,0,0,0,0|0,0,2]=4 7389 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000760410 [0,2,0,0,0,0|0,0,2]=4 7390 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)F 34a_100000210426_100000760410 [0,2,0,0,0,0|0,0,2]=4 7391 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000760410 [0,2,0,0,0,0|0,0,2]=4 7392 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)I 34a_100000211634_100000760410 [0,2,0,0,0,0|0,0,2]=4 7393 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000760410 [0,2,0,0,0,0|0,0,2]=4 7394 B16R1.659 CCCOC(=O)C(C)Oc1cccc(c1)N 34a_100000210217_100000760410 [0,2,0,0,0,0|0,0,2]=4 7395 B16R1.851 C=CC(C)CC(=O)CCc1cccc(c1)Br 1458a_100011934298_100011740638 [0,2,0,0,0,0|2,0,0]=4 7396 B16R1.851 C=CC(C)CC(=O)CCc1cccc(c1)C 1458a_100011934298_100011713685 [0,2,0,0,0,0|2,0,0]=4 7397 B16R1.851 C=CC(C)CC(=O)CCc1cccc(c1)Cl 1458a_100011934298_100011713710 [0,2,0,0,0,0|2,0,0]=4 7398 B16R1.851 C=CC(C)CC(=O)CCc1cccc(c1)F 1458a_100011934298_100011217235 [0,2,0,0,0,0|2,0,0]=4 7399 B16R1.980 C=CCC(C)C(=O)CCc1cccc(c1)Br 1458a_100011216819_100011740638 [0,2,0,0,0,0|2,0,0]=4 7400 B16R1.980 C=CCC(C)C(=O)CCc1cccc(c1)C 1458a_100011216819_100011713685 [0,2,0,0,0,0|2,0,0]=4 7401 B16R1.980 C=CCC(C)C(=O)CCc1cccc(c1)Cl 1458a_100011216819_100011713710 [0,2,0,0,0,0|2,0,0]=4 7402 B16R1.980 C=CCC(C)C(=O)CCc1cccc(c1)F 1458a_100011216819_100011217235 [0,2,0,0,0,0|2,0,0]=4 7403 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Br 11a_100000225617_100000184314 [0,2,0,0,0,0|2,0,0]=4 7404 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Br 1626a_100000225617_100000184314 [0,2,0,0,0,0|2,0,0]=4 7405 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Br 240690a_100000225617_100000184314 [0,2,0,0,0,0|2,0,0]=4 7406 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Br 527a_100000225617_100000184314 [0,2,0,0,0,0|2,0,0]=4 7407 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)C 11a_100000225617_100000234952 [0,2,0,0,0,0|2,0,0]=4 7408 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)C 1626a_100000225617_100000234952 [0,2,0,0,0,0|2,0,0]=4 7409 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)C 240690a_100000225617_100000234952 [0,2,0,0,0,0|2,0,0]=4 7410 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)C 527a_100000225617_100000234952 [0,2,0,0,0,0|2,0,0]=4 7411 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Cl 11a_100000225617_100000235675 [0,2,0,0,0,0|2,0,0]=4 7412 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Cl 1626a_100000225617_100000235675 [0,2,0,0,0,0|2,0,0]=4 7413 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Cl 240690a_100000225617_100000235675 [0,2,0,0,0,0|2,0,0]=4 7414 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)Cl 527a_100000225617_100000235675 [0,2,0,0,0,0|2,0,0]=4 7415 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)F 11a_100000225617_100000235673 [0,2,0,0,0,0|2,0,0]=4 7416 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)F 1626a_100000225617_100000235673 [0,2,0,0,0,0|2,0,0]=4 7417 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)F 240690a_100000225617_100000235673 [0,2,0,0,0,0|2,0,0]=4 7418 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)F 527a_100000225617_100000235673 [0,2,0,0,0,0|2,0,0]=4 7419 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)I 11a_100000225617_100010007846 [0,2,0,0,0,0|2,0,0]=4 7420 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)I 1626a_100000225617_100010007846 [0,2,0,0,0,0|2,0,0]=4 7421 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)I 240690a_100000225617_100010007846 [0,2,0,0,0,0|2,0,0]=4 7422 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)I 527a_100000225617_100010007846 [0,2,0,0,0,0|2,0,0]=4 7423 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)O 240690a_100000225617_100011216126 [0,2,0,0,0,0|2,0,0]=4 7424 B16R1.980 C=CCN(C)C(=O)CCc1cccc(c1)O 527a_100000225617_100011216126 [0,2,0,0,0,0|2,0,0]=4 7425 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Br 11a_100000225617_100000182359 [0,2,0,0,0,0|1,0,0]=3 7426 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Br 1626a_100000225617_100000182359 [0,2,0,0,0,0|1,0,0]=3 7427 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Br 240690a_100000225617_100000182359 [0,2,0,0,0,0|1,0,0]=3 7428 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Br 527a_100000225617_100000182359 [0,2,0,0,0,0|1,0,0]=3 7429 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)C 11a_100000225617_100000183606 [0,2,0,0,0,0|1,0,0]=3 7430 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)C 1626a_100000225617_100000183606 [0,2,0,0,0,0|1,0,0]=3 7431 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)C 240690a_100000225617_100000183606 [0,2,0,0,0,0|1,0,0]=3 7432 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)C 527a_100000225617_100000183606 [0,2,0,0,0,0|1,0,0]=3 7433 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Cl 11a_100000225617_100000184978 [0,2,0,0,0,0|1,0,0]=3 7434 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Cl 1626a_100000225617_100000184978 [0,2,0,0,0,0|1,0,0]=3 7435 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Cl 240690a_100000225617_100000184978 [0,2,0,0,0,0|1,0,0]=3 7436 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)Cl 527a_100000225617_100000184978 [0,2,0,0,0,0|1,0,0]=3 7437 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)F 11a_100000225617_100000182781 [0,2,0,0,0,0|1,0,0]=3 7438 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)F 1626a_100000225617_100000182781 [0,2,0,0,0,0|1,0,0]=3 7439 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)F 240690a_100000225617_100000182781 [0,2,0,0,0,0|1,0,0]=3 7440 B16R1.980 C=CCN(C)C(=O)COc1cccc(c1)F 527a_100000225617_100000182781 [0,2,0,0,0,0|1,0,0]=3 7441 B16R1.980 C=CCN(C)C(=O)CSc1cccc(c1)Br 11a_100000225617_100000760868 [0,2,0,0,0,0|1,1,0]=4 7442 B16R1.980 C=CCN(C)C(=O)CSc1cccc(c1)Br 1626a_100000225617_100000760868 [0,2,0,0,0,0|1,1,0]=4 7443 B16R1.980 C=CCN(C)C(=O)CSc1cccc(c1)Br 240690a_100000225617_100000760868 [0,2,0,0,0,0|1,1,0]=4 7444 B16R1.980 C=CCN(C)C(=O)CSc1cccc(c1)Br 527a_100000225617_100000760868 [0,2,0,0,0,0|1,1,0]=4 7445 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1Br)F 1458a_100000685340_100000754431 [0,2,0,0,0,0|2,0,0]=4 7446 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1C)C 1458a_100011485725_100000754431 [0,2,0,0,0,0|2,0,0]=4 7447 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1C)F 1458a_100011830270_100000754431 [0,2,0,0,0,0|2,0,0]=4 7448 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_100000754431 [0,2,0,0,0,0|2,0,0]=4 7449 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_100000754431 [0,2,0,0,0,0|2,0,0]=4 7450 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_100000754431 [0,2,0,0,0,0|2,0,0]=4 7451 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1F)Br 1458a_100000694007_100000754431 [0,2,0,0,0,0|2,0,0]=4 7452 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1F)C 1458a_100011934859_100000754431 [0,2,0,0,0,0|2,0,0]=4 7453 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_100000754431 [0,2,0,0,0,0|2,0,0]=4 7454 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1F)F 1458a_100000744313_100000754431 [0,2,0,0,0,0|2,0,0]=4 7455 B16R1.7334 C=CCCC(=O)CCc1cc(ccc1F)F 1458a_100000749702_100011755056 [0,2,0,0,0,0|2,0,0]=4 7456 B16R1.7334 C=CCCC(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_100000754431 [0,2,0,0,0,0|1,0,0]=3 7457 B16R1.7334 C=CCCC(=O)COc1cc(ccc1C)C 1458a_100000182428_100000754431 [0,2,0,0,0,0|1,0,0]=3 7458 B16R1.7334 C=CCCC(=O)COc1cc(ccc1Cl)C 1458a_100000183693_100000754431 [0,2,0,0,0,0|1,0,0]=3 7459 B16R1.7334 C=CCCC(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_100000754431 [0,2,0,0,0,0|1,0,0]=3 7460 B16R1.7334 C=CCCC(=O)COc1cc(ccc1F)F 1458a_100000752474_100000754431 [0,2,0,0,0,0|1,0,0]=3 7461 B16R1.7334 C=CCCC(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_100000754431 [0,2,0,0,0,0|1,1,0]=4 7462 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Br)F 1626a_100020586998_100000685340 [0,2,0,0,0,0|2,0,0]=4 7463 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Br)F 240690a_100020586998_100000685340 [0,2,0,0,0,0|2,0,0]=4 7464 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Br)F 527a_100020586998_100000685340 [0,2,0,0,0,0|2,0,0]=4 7465 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)C 1626a_100020586998_100011485725 [0,2,0,0,0,0|2,0,0]=4 7466 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)C 240690a_100020586998_100011485725 [0,2,0,0,0,0|2,0,0]=4 7467 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)C 527a_100020586998_100011485725 [0,2,0,0,0,0|2,0,0]=4 7468 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)F 1626a_100020586998_100011830270 [0,2,0,0,0,0|2,0,0]=4 7469 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)F 240690a_100020586998_100011830270 [0,2,0,0,0,0|2,0,0]=4 7470 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1C)F 527a_100020586998_100011830270 [0,2,0,0,0,0|2,0,0]=4 7471 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Br 1626a_100020586998_100010145785 [0,2,0,0,0,0|2,0,0]=4 7472 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Br 240690a_100020586998_100010145785 [0,2,0,0,0,0|2,0,0]=4 7473 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Br 527a_100020586998_100010145785 [0,2,0,0,0,0|2,0,0]=4 7474 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Cl 1626a_100020586998_200012258936 [0,2,0,0,0,0|2,0,0]=4 7475 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Cl 240690a_100020586998_200012258936 [0,2,0,0,0,0|2,0,0]=4 7476 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)Cl 527a_100020586998_200012258936 [0,2,0,0,0,0|2,0,0]=4 7477 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)F 1626a_100020586998_100012357546 [0,2,0,0,0,0|2,0,0]=4 7478 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)F 240690a_100020586998_100012357546 [0,2,0,0,0,0|2,0,0]=4 7479 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1Cl)F 527a_100020586998_100012357546 [0,2,0,0,0,0|2,0,0]=4 7480 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Br 1626a_100020586998_100000694007 [0,2,0,0,0,0|2,0,0]=4 7481 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Br 240690a_100020586998_100000694007 [0,2,0,0,0,0|2,0,0]=4 7482 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Br 527a_100020586998_100000694007 [0,2,0,0,0,0|2,0,0]=4 7483 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)C 1626a_100020586998_100011934859 [0,2,0,0,0,0|2,0,0]=4 7484 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)C 240690a_100020586998_100011934859 [0,2,0,0,0,0|2,0,0]=4 7485 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)C 527a_100020586998_100011934859 [0,2,0,0,0,0|2,0,0]=4 7486 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Cl 1626a_100020586998_200012349660 [0,2,0,0,0,0|2,0,0]=4 7487 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Cl 240690a_100020586998_200012349660 [0,2,0,0,0,0|2,0,0]=4 7488 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)Cl 527a_100020586998_200012349660 [0,2,0,0,0,0|2,0,0]=4 7489 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)F 1626a_100020586998_100000744313 [0,2,0,0,0,0|2,0,0]=4 7490 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)F 240690a_100020586998_100000744313 [0,2,0,0,0,0|2,0,0]=4 7491 B16R1.7334 C=CCNC(=O)CCc1cc(ccc1F)F 527a_100020586998_100000744313 [0,2,0,0,0,0|2,0,0]=4 7492 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)Br 7a_100000741167_100000183597 [0,2,0,0,0,0|2,0,0]=4 7493 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)C 2230a_100000185781_100000183597 [0,2,0,0,0,0|2,0,0]=4 7494 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)C 7a_100000185781_100000183597 [0,2,0,0,0,0|2,0,0]=4 7495 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)Cl 7a_100000211374_100000183597 [0,2,0,0,0,0|2,0,0]=4 7496 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)F 7a_100000211107_100000183597 [0,2,0,0,0,0|2,0,0]=4 7497 B16R1.7334 C=CCNC(=O)CNc1cc(ccc1C)I 7a_100000761890_100000183597 [0,2,0,0,0,0|2,0,0]=4 7498 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)Br 7a_100011220040_100000183597 [0,2,0,0,0,0|1,0,0]=3 7499 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)C 7a_100012002257_100000183597 [0,2,0,0,0,0|1,0,0]=3 7500 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)Cl 1626a_100020586998_100015481456 [0,2,0,0,0,0|1,0,0]=3 7501 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)Cl 240690a_100020586998_100015481456 [0,2,0,0,0,0|1,0,0]=3 7502 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)Cl 527a_100020586998_100015481456 [0,2,0,0,0,0|1,0,0]=3 7503 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)Cl 7a_100012339455_100000183597 [0,2,0,0,0,0|1,0,0]=3 7504 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)F 7a_100000690578_100000183597 [0,2,0,0,0,0|1,0,0]=3 7505 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Br)I 7a_100012356990_100000183597 [0,2,0,0,0,0|1,0,0]=3 7506 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)Br 7a_100000685420_100000183597 [0,2,0,0,0,0|1,0,0]=3 7507 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)C 1626a_100020586998_100000182428 [0,2,0,0,0,0|1,0,0]=3 7508 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)C 240690a_100020586998_100000182428 [0,2,0,0,0,0|1,0,0]=3 7509 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)C 527a_100020586998_100000182428 [0,2,0,0,0,0|1,0,0]=3 7510 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)C 7a_100000210931_100000183597 [0,2,0,0,0,0|1,0,0]=3 7511 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)Cl 7a_100000756515_100000183597 [0,2,0,0,0,0|1,0,0]=3 7512 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)F 7a_100000690566_100000183597 [0,2,0,0,0,0|1,0,0]=3 7513 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)I 7a_100000766334_100000183597 [0,2,0,0,0,0|1,0,0]=3 7514 B16R1.7334 C=CCNC(=O)COc1cc(ccc1C)N 7a_100000759471_100000183597 [0,2,0,0,0,0|1,0,0]=3 7515 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)Br 7a_100000738945_100000183597 [0,2,0,0,0,0|1,0,0]=3 7516 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)C 1626a_100020586998_100000183693 [0,2,0,0,0,0|1,0,0]=3 7517 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)C 240690a_100020586998_100000183693 [0,2,0,0,0,0|1,0,0]=3 7518 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)C 527a_100020586998_100000183693 [0,2,0,0,0,0|1,0,0]=3 7519 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)C 7a_100000211493_100000183597 [0,2,0,0,0,0|1,0,0]=3 7520 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)Cl 1626a_100020586998_100000187393 [0,2,0,0,0,0|1,0,0]=3 7521 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)Cl 240690a_100020586998_100000187393 [0,2,0,0,0,0|1,0,0]=3 7522 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)Cl 527a_100020586998_100000187393 [0,2,0,0,0,0|1,0,0]=3 7523 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)Cl 7a_100000211422_100000183597 [0,2,0,0,0,0|1,0,0]=3 7524 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)F 7a_100000692107_100000183597 [0,2,0,0,0,0|1,0,0]=3 7525 B16R1.7334 C=CCNC(=O)COc1cc(ccc1Cl)I 7a_100011356854_100000183597 [0,2,0,0,0,0|1,0,0]=3 7526 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)Br 7a_100000686035_100000183597 [0,2,0,0,0,0|1,0,0]=3 7527 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)C 7a_100000759540_100000183597 [0,2,0,0,0,0|1,0,0]=3 7528 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)Cl 7a_100000757397_100000183597 [0,2,0,0,0,0|1,0,0]=3 7529 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)F 1626a_100020586998_100000752474 [0,2,0,0,0,0|1,0,0]=3 7530 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)F 240690a_100020586998_100000752474 [0,2,0,0,0,0|1,0,0]=3 7531 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)F 527a_100020586998_100000752474 [0,2,0,0,0,0|1,0,0]=3 7532 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)F 7a_100000752141_100000183597 [0,2,0,0,0,0|1,0,0]=3 7533 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)I 7a_100009958187_100000183597 [0,2,0,0,0,0|1,0,0]=3 7534 B16R1.7334 C=CCNC(=O)COc1cc(ccc1F)N 7a_100012017398_100000183597 [0,2,0,0,0,0|1,0,0]=3 7535 B16R1.7334 C=CCNC(=O)COc1cc(ccc1I)Br 7a_100012344904_100000183597 [0,2,0,0,0,0|1,0,0]=3 7536 B16R1.7334 C=CCNC(=O)COc1cc(ccc1I)Cl 7a_100000050036_100000183597 [0,2,0,0,0,0|1,0,0]=3 7537 B16R1.7334 C=CCNC(=O)COc1cc(ccc1I)F 7a_100010084537_100000183597 [0,2,0,0,0,0|1,0,0]=3 7538 B16R1.7334 C=CCNC(=O)COc1cc(ccc1N)Br 7a_100000739049_100000183597 [0,2,0,0,0,0|1,0,0]=3 7539 B16R1.7334 C=CCNC(=O)COc1cc(ccc1N)C 7a_100000211527_100000183597 [0,2,0,0,0,0|1,0,0]=3 7540 B16R1.7334 C=CCNC(=O)COc1cc(ccc1N)Cl 7a_100000185728_100000183597 [0,2,0,0,0,0|1,0,0]=3 7541 B16R1.7334 C=CCNC(=O)COc1cc(ccc1N)F 7a_100000753323_100000183597 [0,2,0,0,0,0|1,0,0]=3 7542 B16R1.7334 C=CCNC(=O)COc1cc(ccc1N)I 7a_100000057187_100000183597 [0,2,0,0,0,0|1,0,0]=3 7543 B16R1.7334 C=CCNC(=O)COc1cc(cnc1Br)Cl 7a_100000697010_100000183597 [0,2,0,0,0,0|2,0,0]=4 7544 B16R1.7334 C=CCNC(=O)COc1cc(cnc1Br)F 7a_100009820119_100000183597 [0,2,0,0,0,0|2,0,0]=4 7545 B16R1.7334 C=CCNC(=O)COc1cc(cnc1C)Br 7a_100009864810_100000183597 [0,2,0,0,0,0|2,0,0]=4 7546 B16R1.7334 C=CCNC(=O)COc1cc(cnc1Cl)Br 7a_100012354860_100000183597 [0,2,0,0,0,0|2,0,0]=4 7547 B16R1.7334 C=CCNC(=O)COc1cc(cnc1Cl)C 7a_100012000487_100000183597 [0,2,0,0,0,0|2,0,0]=4 7548 B16R1.7334 C=CCNC(=O)COc1cc(cnc1Cl)F 7a_100000079967_100000183597 [0,2,0,0,0,0|2,0,0]=4 7549 B16R1.7334 C=CCNC(=O)COc1cc(cnc1F)Br 7a_100009819871_100000183597 [0,2,0,0,0,0|2,0,0]=4 7550 B16R1.7334 C=CCNC(=O)COc1cc(cnc1F)C 7a_100009849810_100000183597 [0,2,0,0,0,0|2,0,0]=4 7551 B16R1.7334 C=CCNC(=O)COc1cc(cnc1F)Cl 7a_100000094372_100000183597 [0,2,0,0,0,0|2,0,0]=4 7552 B16R1.7334 C=CCNC(=O)COc1cc(cnc1I)Br 7a_100010210634_100000183597 [0,2,0,0,0,0|2,0,0]=4 7553 B16R1.7334 C=CCNC(=O)COc1cc(cnc1I)Cl 7a_100010233512_100000183597 [0,2,0,0,0,0|2,0,0]=4 7554 B16R1.7334 C=CCNC(=O)COc1cc(cnc1I)F 7a_100015624800_100000183597 [0,2,0,0,0,0|2,0,0]=4 7555 B16R1.7334 C=CCNC(=O)COc1cc(cnc1N)Br 7a_100009819042_100000183597 [0,2,0,0,0,0|2,0,0]=4 7556 B16R1.7334 C=CCNC(=O)COc1cc(cnc1N)Cl 7a_100000123674_100000183597 [0,2,0,0,0,0|2,0,0]=4 7557 B16R1.7334 C=CCNC(=O)COc1cc(cnc1N)F 7a_100000094369_100000183597 [0,2,0,0,0,0|2,0,0]=4 7558 B16R1.7334 C=CCNC(=O)COc1cc(ncc1C)Br 7a_100000704368_100000183597 [0,2,0,0,0,0|2,0,0]=4 7559 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)Br 62a_100000183597_100011483371 [0,2,0,0,0,0|1,1,0]=4 7560 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)Br 62a_100011483371_100000183597 [0,2,0,0,0,0|1,1,0]=4 7561 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)C 62a_100000183597_100012353751 [0,2,0,0,0,0|1,1,0]=4 7562 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)C 62a_100012353751_100000183597 [0,2,0,0,0,0|1,1,0]=4 7563 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)Cl 62a_100000183597_100012339723 [0,2,0,0,0,0|1,1,0]=4 7564 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)Cl 62a_100012339723_100000183597 [0,2,0,0,0,0|1,1,0]=4 7565 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)F 62a_100000183597_100011217576 [0,2,0,0,0,0|1,1,0]=4 7566 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)F 62a_100011217576_100000183597 [0,2,0,0,0,0|1,1,0]=4 7567 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)N 62a_100000183597_100000750459 [0,2,0,0,0,0|1,1,0]=4 7568 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)N 62a_100000750459_100000183597 [0,2,0,0,0,0|1,1,0]=4 7569 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)O 62a_100000183597_100012339312 [0,2,0,0,0,0|1,1,0]=4 7570 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Br)O 62a_100012339312_100000183597 [0,2,0,0,0,0|1,1,0]=4 7571 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)Br 62a_100000183597_100011344865 [0,2,0,0,0,0|1,1,0]=4 7572 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)Br 62a_100011344865_100000183597 [0,2,0,0,0,0|1,1,0]=4 7573 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)C 62a_100000183597_100000210833 [0,2,0,0,0,0|1,1,0]=4 7574 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)C 62a_100000210833_100000183597 [0,2,0,0,0,0|1,1,0]=4 7575 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)Cl 62a_100000183597_100011263213 [0,2,0,0,0,0|1,1,0]=4 7576 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)Cl 62a_100011263213_100000183597 [0,2,0,0,0,0|1,1,0]=4 7577 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)F 62a_100000183597_100011218078 [0,2,0,0,0,0|1,1,0]=4 7578 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)F 62a_100011218078_100000183597 [0,2,0,0,0,0|1,1,0]=4 7579 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)N 62a_100000183597_100000736455 [0,2,0,0,0,0|1,1,0]=4 7580 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)N 62a_100000736455_100000183597 [0,2,0,0,0,0|1,1,0]=4 7581 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)O 62a_100000183597_100011380479 [0,2,0,0,0,0|1,1,0]=4 7582 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1C)O 62a_100011380479_100000183597 [0,2,0,0,0,0|1,1,0]=4 7583 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Br 62a_100000183597_100011772130 [0,2,0,0,0,0|1,1,0]=4 7584 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Br 62a_100011772130_100000183597 [0,2,0,0,0,0|1,1,0]=4 7585 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)C 62a_100000183597_100012356289 [0,2,0,0,0,0|1,1,0]=4 7586 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)C 62a_100012356289_100000183597 [0,2,0,0,0,0|1,1,0]=4 7587 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Cl 1626a_100020586998_100000179523 [0,2,0,0,0,0|1,1,0]=4 7588 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Cl 240690a_100020586998_100000179523 [0,2,0,0,0,0|1,1,0]=4 7589 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Cl 527a_100020586998_100000179523 [0,2,0,0,0,0|1,1,0]=4 7590 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Cl 62a_100000183597_100000707729 [0,2,0,0,0,0|1,1,0]=4 7591 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)Cl 62a_100000707729_100000183597 [0,2,0,0,0,0|1,1,0]=4 7592 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)F 62a_100000183597_100011217299 [0,2,0,0,0,0|1,1,0]=4 7593 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)F 62a_100011217299_100000183597 [0,2,0,0,0,0|1,1,0]=4 7594 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)N 62a_100000183597_100012360549 [0,2,0,0,0,0|1,1,0]=4 7595 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)N 62a_100012360549_100000183597 [0,2,0,0,0,0|1,1,0]=4 7596 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)O 62a_100000049588_100000183597 [0,2,0,0,0,0|1,1,0]=4 7597 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1Cl)O 62a_100000183597_100000049588 [0,2,0,0,0,0|1,1,0]=4 7598 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)Br 62a_100000183597_100011217312 [0,2,0,0,0,0|1,1,0]=4 7599 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)Br 62a_100011217312_100000183597 [0,2,0,0,0,0|1,1,0]=4 7600 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)C 62a_100000183597_100000736223 [0,2,0,0,0,0|1,1,0]=4 7601 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)C 62a_100000736223_100000183597 [0,2,0,0,0,0|1,1,0]=4 7602 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)Cl 62a_100000183597_100011218116 [0,2,0,0,0,0|1,1,0]=4 7603 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)Cl 62a_100011218116_100000183597 [0,2,0,0,0,0|1,1,0]=4 7604 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)F 62a_100000183597_100011219198 [0,2,0,0,0,0|1,1,0]=4 7605 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)F 62a_100011219198_100000183597 [0,2,0,0,0,0|1,1,0]=4 7606 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)N 62a_100000183597_100000760356 [0,2,0,0,0,0|1,1,0]=4 7607 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)N 62a_100000760356_100000183597 [0,2,0,0,0,0|1,1,0]=4 7608 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)O 62a_100000183597_100000693481 [0,2,0,0,0,0|1,1,0]=4 7609 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1F)O 62a_100000693481_100000183597 [0,2,0,0,0,0|1,1,0]=4 7610 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)Br 62a_100000183597_100000187925 [0,2,0,0,0,0|1,1,0]=4 7611 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)Br 62a_100000187925_100000183597 [0,2,0,0,0,0|1,1,0]=4 7612 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)C 62a_100000183597_100011356834 [0,2,0,0,0,0|1,1,0]=4 7613 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)C 62a_100011356834_100000183597 [0,2,0,0,0,0|1,1,0]=4 7614 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)Cl 62a_100000183597_100000761889 [0,2,0,0,0,0|1,1,0]=4 7615 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)Cl 62a_100000761889_100000183597 [0,2,0,0,0,0|1,1,0]=4 7616 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)F 62a_100000183597_100000760547 [0,2,0,0,0,0|1,1,0]=4 7617 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)F 62a_100000760547_100000183597 [0,2,0,0,0,0|1,1,0]=4 7618 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)N 62a_100000183597_100011534242 [0,2,0,0,0,0|1,1,0]=4 7619 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)N 62a_100011534242_100000183597 [0,2,0,0,0,0|1,1,0]=4 7620 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)O 62a_100000183597_100012001276 [0,2,0,0,0,0|1,1,0]=4 7621 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1N)O 62a_100012001276_100000183597 [0,2,0,0,0,0|1,1,0]=4 7622 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)Br 62a_100000183597_100012355227 [0,2,0,0,0,0|1,1,0]=4 7623 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)Br 62a_100012355227_100000183597 [0,2,0,0,0,0|1,1,0]=4 7624 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)C 62a_100000183597_100000765521 [0,2,0,0,0,0|1,1,0]=4 7625 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)C 62a_100000765521_100000183597 [0,2,0,0,0,0|1,1,0]=4 7626 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)Cl 62a_100000183597_100011356953 [0,2,0,0,0,0|1,1,0]=4 7627 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)Cl 62a_100011356953_100000183597 [0,2,0,0,0,0|1,1,0]=4 7628 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)F 62a_100000183597_100000211999 [0,2,0,0,0,0|1,1,0]=4 7629 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)F 62a_100000211999_100000183597 [0,2,0,0,0,0|1,1,0]=4 7630 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)N 62a_100000183597_100011534360 [0,2,0,0,0,0|1,1,0]=4 7631 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)N 62a_100011534360_100000183597 [0,2,0,0,0,0|1,1,0]=4 7632 B16R1.7334 C=CCNC(=O)CSc1cc(ccc1O)O 62a_100000183597_100009813629 [0,2,0,0,0,0|1,1,0]=4 7633 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Br)Br 34a_100000737762_100000033060 [0,2,0,0,0,0|1,0,0]=3 7634 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Br)C 34a_100000745044_100000033060 [0,2,0,0,0,0|1,0,0]=3 7635 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Br)Cl 34a_100000687073_100000033060 [0,2,0,0,0,0|1,0,0]=3 7636 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Br)F 34a_100000687223_100000033060 [0,2,0,0,0,0|1,0,0]=3 7637 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Br)O 34a_100011999798_100000033060 [0,2,0,0,0,0|1,0,0]=3 7638 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)Br 34a_100000741167_100000033060 [0,2,0,0,0,0|1,0,0]=3 7639 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)Br 7a_100000741167_100000033060 [0,2,0,0,0,0|1,0,0]=3 7640 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)C 2230a_100000185781_100000033060 [0,2,0,0,0,0|1,0,0]=3 7641 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)C 34a_100000185781_100000033060 [0,2,0,0,0,0|1,0,0]=3 7642 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)C 7a_100000185781_100000033060 [0,2,0,0,0,0|1,0,0]=3 7643 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)Cl 34a_100000211374_100000033060 [0,2,0,0,0,0|1,0,0]=3 7644 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)Cl 7a_100000211374_100000033060 [0,2,0,0,0,0|1,0,0]=3 7645 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)F 34a_100000211107_100000033060 [0,2,0,0,0,0|1,0,0]=3 7646 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)F 7a_100000211107_100000033060 [0,2,0,0,0,0|1,0,0]=3 7647 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)I 7a_100000761890_100000033060 [0,2,0,0,0,0|1,0,0]=3 7648 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1C)O 34a_100011216113_100000033060 [0,2,0,0,0,0|1,0,0]=3 7649 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)Br 34a_100000750497_100000033060 [0,2,0,0,0,0|1,0,0]=3 7650 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)C 34a_100011215360_100000033060 [0,2,0,0,0,0|1,0,0]=3 7651 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)Cl 34a_100000184485_100000033060 [0,2,0,0,0,0|1,0,0]=3 7652 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)F 34a_100000751338_100000033060 [0,2,0,0,0,0|1,0,0]=3 7653 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)I 34a_200000761891_100000033060 [0,2,0,0,0,0|1,0,0]=3 7654 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1Cl)O 34a_100011934297_100000033060 [0,2,0,0,0,0|1,0,0]=3 7655 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)Br 34a_100000740924_100000033060 [0,2,0,0,0,0|1,0,0]=3 7656 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)C 34a_100000211285_100000033060 [0,2,0,0,0,0|1,0,0]=3 7657 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)Cl 34a_100000212115_100000033060 [0,2,0,0,0,0|1,0,0]=3 7658 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)F 34a_100000210742_100000033060 [0,2,0,0,0,0|1,0,0]=3 7659 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)I 34a_100011464823_100000033060 [0,2,0,0,0,0|1,0,0]=3 7660 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1F)O 34a_100012017239_100000033060 [0,2,0,0,0,0|1,0,0]=3 7661 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1I)Br 34a_100000743836_100000033060 [0,2,0,0,0,0|1,0,0]=3 7662 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1I)C 34a_100011216686_100000033060 [0,2,0,0,0,0|1,0,0]=3 7663 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1I)Cl 34a_100000761886_100000033060 [0,2,0,0,0,0|1,0,0]=3 7664 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1I)F 34a_100011218093_100000033060 [0,2,0,0,0,0|1,0,0]=3 7665 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1O)Br 34a_100000752626_100000033060 [0,2,0,0,0,0|1,0,0]=3 7666 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1O)C 34a_100011215204_100000033060 [0,2,0,0,0,0|1,0,0]=3 7667 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1O)Cl 34a_100000210500_100000033060 [0,2,0,0,0,0|1,0,0]=3 7668 B16R1.7334 C=CCOC(=O)CNc1cc(ccc1O)F 34a_100000759472_100000033060 [0,2,0,0,0,0|1,0,0]=3 7669 B16R1.7334 C=CCOC(=O)COc1cc(=O)[nH]cc1Cl 34a_100000069390_100000033060 [0,2,0,0,0,0|1,0,0]=3 7670 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)Br 34a_100011220040_100000033060 [0,2,0,0,0,0|0,0,0]=2 7671 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)Br 7a_100011220040_100000033060 [0,2,0,0,0,0|0,0,0]=2 7672 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)C 34a_100012002257_100000033060 [0,2,0,0,0,0|0,0,0]=2 7673 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)C 7a_100012002257_100000033060 [0,2,0,0,0,0|0,0,0]=2 7674 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)Cl 34a_100012339455_100000033060 [0,2,0,0,0,0|0,0,0]=2 7675 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)Cl 7a_100012339455_100000033060 [0,2,0,0,0,0|0,0,0]=2 7676 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)F 34a_100000690578_100000033060 [0,2,0,0,0,0|0,0,0]=2 7677 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)F 7a_100000690578_100000033060 [0,2,0,0,0,0|0,0,0]=2 7678 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)I 34a_100012356990_100000033060 [0,2,0,0,0,0|0,0,0]=2 7679 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Br)I 7a_100012356990_100000033060 [0,2,0,0,0,0|0,0,0]=2 7680 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)Br 34a_100000685420_100000033060 [0,2,0,0,0,0|0,0,0]=2 7681 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)Br 7a_100000685420_100000033060 [0,2,0,0,0,0|0,0,0]=2 7682 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)C 34a_100000210931_100000033060 [0,2,0,0,0,0|0,0,0]=2 7683 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)C 7a_100000210931_100000033060 [0,2,0,0,0,0|0,0,0]=2 7684 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)Cl 34a_100000756515_100000033060 [0,2,0,0,0,0|0,0,0]=2 7685 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)Cl 7a_100000756515_100000033060 [0,2,0,0,0,0|0,0,0]=2 7686 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)F 34a_100000690566_100000033060 [0,2,0,0,0,0|0,0,0]=2 7687 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)F 7a_100000690566_100000033060 [0,2,0,0,0,0|0,0,0]=2 7688 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)I 7a_100000766334_100000033060 [0,2,0,0,0,0|0,0,0]=2 7689 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)N 34a_100000759471_100000033060 [0,2,0,0,0,0|0,0,0]=2 7690 B16R1.7334 C=CCOC(=O)COc1cc(ccc1C)N 7a_100000759471_100000033060 [0,2,0,0,0,0|0,0,0]=2 7691 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)Br 34a_100000738945_100000033060 [0,2,0,0,0,0|0,0,0]=2 7692 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)Br 7a_100000738945_100000033060 [0,2,0,0,0,0|0,0,0]=2 7693 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)C 34a_100000211493_100000033060 [0,2,0,0,0,0|0,0,0]=2 7694 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)C 7a_100000211493_100000033060 [0,2,0,0,0,0|0,0,0]=2 7695 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)Cl 34a_100000211422_100000033060 [0,2,0,0,0,0|0,0,0]=2 7696 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)Cl 7a_100000211422_100000033060 [0,2,0,0,0,0|0,0,0]=2 7697 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)F 34a_100000692107_100000033060 [0,2,0,0,0,0|0,0,0]=2 7698 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)F 7a_100000692107_100000033060 [0,2,0,0,0,0|0,0,0]=2 7699 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)I 34a_100011356854_100000033060 [0,2,0,0,0,0|0,0,0]=2 7700 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)I 7a_100011356854_100000033060 [0,2,0,0,0,0|0,0,0]=2 7701 B16R1.7334 C=CCOC(=O)COc1cc(ccc1Cl)N 34a_100011934209_100000033060 [0,2,0,0,0,0|0,0,0]=2 7702 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)Br 34a_100000686035_100000033060 [0,2,0,0,0,0|0,0,0]=2 7703 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)Br 7a_100000686035_100000033060 [0,2,0,0,0,0|0,0,0]=2 7704 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)C 34a_100000759540_100000033060 [0,2,0,0,0,0|0,0,0]=2 7705 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)C 7a_100000759540_100000033060 [0,2,0,0,0,0|0,0,0]=2 7706 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)Cl 34a_100000757397_100000033060 [0,2,0,0,0,0|0,0,0]=2 7707 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)Cl 7a_100000757397_100000033060 [0,2,0,0,0,0|0,0,0]=2 7708 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)F 34a_100000752141_100000033060 [0,2,0,0,0,0|0,0,0]=2 7709 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)F 7a_100000752141_100000033060 [0,2,0,0,0,0|0,0,0]=2 7710 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)I 34a_100009958187_100000033060 [0,2,0,0,0,0|0,0,0]=2 7711 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)I 7a_100009958187_100000033060 [0,2,0,0,0,0|0,0,0]=2 7712 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)N 34a_100012017398_100000033060 [0,2,0,0,0,0|0,0,0]=2 7713 B16R1.7334 C=CCOC(=O)COc1cc(ccc1F)N 7a_100012017398_100000033060 [0,2,0,0,0,0|0,0,0]=2 7714 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)Br 34a_100012344904_100000033060 [0,2,0,0,0,0|0,0,0]=2 7715 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)Br 7a_100012344904_100000033060 [0,2,0,0,0,0|0,0,0]=2 7716 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)Cl 34a_100000050036_100000033060 [0,2,0,0,0,0|0,0,0]=2 7717 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)Cl 7a_100000050036_100000033060 [0,2,0,0,0,0|0,0,0]=2 7718 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)F 34a_100010084537_100000033060 [0,2,0,0,0,0|0,0,0]=2 7719 B16R1.7334 C=CCOC(=O)COc1cc(ccc1I)F 7a_100010084537_100000033060 [0,2,0,0,0,0|0,0,0]=2 7720 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)Br 34a_100000739049_100000033060 [0,2,0,0,0,0|0,0,0]=2 7721 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)Br 7a_100000739049_100000033060 [0,2,0,0,0,0|0,0,0]=2 7722 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)C 34a_100000211527_100000033060 [0,2,0,0,0,0|0,0,0]=2 7723 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)C 7a_100000211527_100000033060 [0,2,0,0,0,0|0,0,0]=2 7724 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)Cl 34a_100000185728_100000033060 [0,2,0,0,0,0|0,0,0]=2 7725 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)Cl 7a_100000185728_100000033060 [0,2,0,0,0,0|0,0,0]=2 7726 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)F 34a_100000753323_100000033060 [0,2,0,0,0,0|0,0,0]=2 7727 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)F 7a_100000753323_100000033060 [0,2,0,0,0,0|0,0,0]=2 7728 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)I 34a_100000057187_100000033060 [0,2,0,0,0,0|0,0,0]=2 7729 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)I 7a_100000057187_100000033060 [0,2,0,0,0,0|0,0,0]=2 7730 B16R1.7334 C=CCOC(=O)COc1cc(ccc1N)N 34a_100025717382_100000033060 [0,2,0,0,0,0|0,0,0]=2 7731 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Br)Cl 34a_100000697010_100000033060 [0,2,0,0,0,0|1,0,0]=3 7732 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Br)Cl 7a_100000697010_100000033060 [0,2,0,0,0,0|1,0,0]=3 7733 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Br)F 34a_100009820119_100000033060 [0,2,0,0,0,0|1,0,0]=3 7734 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Br)F 7a_100009820119_100000033060 [0,2,0,0,0,0|1,0,0]=3 7735 B16R1.7334 C=CCOC(=O)COc1cc(cnc1C)Br 34a_100009864810_100000033060 [0,2,0,0,0,0|1,0,0]=3 7736 B16R1.7334 C=CCOC(=O)COc1cc(cnc1C)Br 7a_100009864810_100000033060 [0,2,0,0,0,0|1,0,0]=3 7737 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)Br 34a_100012354860_100000033060 [0,2,0,0,0,0|1,0,0]=3 7738 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)Br 7a_100012354860_100000033060 [0,2,0,0,0,0|1,0,0]=3 7739 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)C 34a_100012000487_100000033060 [0,2,0,0,0,0|1,0,0]=3 7740 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)C 7a_100012000487_100000033060 [0,2,0,0,0,0|1,0,0]=3 7741 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)F 34a_100000079967_100000033060 [0,2,0,0,0,0|1,0,0]=3 7742 B16R1.7334 C=CCOC(=O)COc1cc(cnc1Cl)F 7a_100000079967_100000033060 [0,2,0,0,0,0|1,0,0]=3 7743 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)Br 34a_100009819871_100000033060 [0,2,0,0,0,0|1,0,0]=3 7744 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)Br 7a_100009819871_100000033060 [0,2,0,0,0,0|1,0,0]=3 7745 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)C 34a_100009849810_100000033060 [0,2,0,0,0,0|1,0,0]=3 7746 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)C 7a_100009849810_100000033060 [0,2,0,0,0,0|1,0,0]=3 7747 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)Cl 34a_100000094372_100000033060 [0,2,0,0,0,0|1,0,0]=3 7748 B16R1.7334 C=CCOC(=O)COc1cc(cnc1F)Cl 7a_100000094372_100000033060 [0,2,0,0,0,0|1,0,0]=3 7749 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)Br 34a_100010210634_100000033060 [0,2,0,0,0,0|1,0,0]=3 7750 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)Br 7a_100010210634_100000033060 [0,2,0,0,0,0|1,0,0]=3 7751 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)Cl 34a_100010233512_100000033060 [0,2,0,0,0,0|1,0,0]=3 7752 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)Cl 7a_100010233512_100000033060 [0,2,0,0,0,0|1,0,0]=3 7753 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)F 34a_100015624800_100000033060 [0,2,0,0,0,0|1,0,0]=3 7754 B16R1.7334 C=CCOC(=O)COc1cc(cnc1I)F 7a_100015624800_100000033060 [0,2,0,0,0,0|1,0,0]=3 7755 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)Br 34a_100009819042_100000033060 [0,2,0,0,0,0|1,0,0]=3 7756 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)Br 7a_100009819042_100000033060 [0,2,0,0,0,0|1,0,0]=3 7757 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)Cl 34a_100000123674_100000033060 [0,2,0,0,0,0|1,0,0]=3 7758 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)Cl 7a_100000123674_100000033060 [0,2,0,0,0,0|1,0,0]=3 7759 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)F 34a_100000094369_100000033060 [0,2,0,0,0,0|1,0,0]=3 7760 B16R1.7334 C=CCOC(=O)COc1cc(cnc1N)F 7a_100000094369_100000033060 [0,2,0,0,0,0|1,0,0]=3 7761 B16R1.7334 C=CCOC(=O)COc1cc(ncc1Br)Br 34a_100010235016_100000033060 [0,2,0,0,0,0|1,0,0]=3 7762 B16R1.7334 C=CCOC(=O)COc1cc(ncc1Br)C 34a_100011016184_100000033060 [0,2,0,0,0,0|1,0,0]=3 7763 B16R1.7334 C=CCOC(=O)COc1cc(ncc1Br)Cl 34a_100010173860_100000033060 [0,2,0,0,0,0|1,0,0]=3 7764 B16R1.7334 C=CCOC(=O)COc1cc(ncc1C)Br 34a_100000704368_100000033060 [0,2,0,0,0,0|1,0,0]=3 7765 B16R1.7334 C=CCOC(=O)COc1cc(ncc1C)Br 7a_100000704368_100000033060 [0,2,0,0,0,0|1,0,0]=3 7766 B16R1.7334 C=CCOC(=O)COc1cc(ncc1Cl)Br 34a_100010173861_100000033060 [0,2,0,0,0,0|1,0,0]=3 7767 B16R1.7334 C=CCOC(=O)COc1cc(ncc1F)Br 34a_100009854642_100000033060 [0,2,0,0,0,0|1,0,0]=3 7768 B16R1.7334 C=CCOC(=O)COc1cc(ncc1F)Cl 34a_100009851168_100000033060 [0,2,0,0,0,0|1,0,0]=3 7769 B16R1.7334 C=CCOC(=O)COc1cc(nnc1Cl)Cl 34a_100011997201_100000033060 [0,2,0,0,0,0|2,0,0]=4 7770 B16R1.7334 C=CCOC(=O)COc1nc(ccc1Br)C 34a_100009817604_100000033060 [0,2,0,0,0,0|1,0,0]=3 7771 B16R1.7334 C=CCOC(=O)COc1nc(ccc1F)Cl 34a_100010729010_100000033060 [0,2,0,0,0,0|1,0,0]=3 7772 B16R1.7334 C=CCOC(=O)COc1nc(ccc1N)C 34a_100000687486_100000033060 [0,2,0,0,0,0|1,0,0]=3 7773 B16R1.7334 C=CCOC(=O)COc1nc(ncc1F)Cl 34a_100011995740_100000033060 [0,2,0,0,0,0|2,0,0]=4 7774 B16R1.7334 C=CCOC(=O)CSc1cc(=O)[nH]cc1F 62a_100000033060_100009817642 [0,2,0,0,0,0|1,1,0]=4 7775 B16R1.7334 C=CCOC(=O)CSc1cc(=O)[nH]cc1F 62a_100009817642_100000033060 [0,2,0,0,0,0|1,1,0]=4 7776 B16R1.7334 C=CCOC(=O)CSc1cc(c[nH]c1=O)F 62a_100000033060_100009817720 [0,2,0,0,0,0|1,1,0]=4 7777 B16R1.7334 C=CCOC(=O)CSc1cc(c[nH]c1=O)F 62a_100009817720_100000033060 [0,2,0,0,0,0|1,1,0]=4 7778 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)Br 62a_100000033060_100011483371 [0,2,0,0,0,0|0,1,0]=3 7779 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)Br 62a_100011483371_100000033060 [0,2,0,0,0,0|0,1,0]=3 7780 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)C 62a_100000033060_100012353751 [0,2,0,0,0,0|0,1,0]=3 7781 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)C 62a_100012353751_100000033060 [0,2,0,0,0,0|0,1,0]=3 7782 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)Cl 62a_100000033060_100012339723 [0,2,0,0,0,0|0,1,0]=3 7783 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)Cl 62a_100012339723_100000033060 [0,2,0,0,0,0|0,1,0]=3 7784 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)F 62a_100000033060_100011217576 [0,2,0,0,0,0|0,1,0]=3 7785 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)F 62a_100011217576_100000033060 [0,2,0,0,0,0|0,1,0]=3 7786 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)N 62a_100000033060_100000750459 [0,2,0,0,0,0|0,1,0]=3 7787 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)N 62a_100000750459_100000033060 [0,2,0,0,0,0|0,1,0]=3 7788 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)O 62a_100000033060_100012339312 [0,2,0,0,0,0|0,1,0]=3 7789 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Br)O 62a_100012339312_100000033060 [0,2,0,0,0,0|0,1,0]=3 7790 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)Br 62a_100000033060_100011344865 [0,2,0,0,0,0|0,1,0]=3 7791 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)Br 62a_100011344865_100000033060 [0,2,0,0,0,0|0,1,0]=3 7792 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)C 62a_100000033060_100000210833 [0,2,0,0,0,0|0,1,0]=3 7793 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)C 62a_100000210833_100000033060 [0,2,0,0,0,0|0,1,0]=3 7794 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)Cl 62a_100000033060_100011263213 [0,2,0,0,0,0|0,1,0]=3 7795 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)Cl 62a_100011263213_100000033060 [0,2,0,0,0,0|0,1,0]=3 7796 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)F 62a_100000033060_100011218078 [0,2,0,0,0,0|0,1,0]=3 7797 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)F 62a_100011218078_100000033060 [0,2,0,0,0,0|0,1,0]=3 7798 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)N 62a_100000033060_100000736455 [0,2,0,0,0,0|0,1,0]=3 7799 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)N 62a_100000736455_100000033060 [0,2,0,0,0,0|0,1,0]=3 7800 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)O 62a_100000033060_100011380479 [0,2,0,0,0,0|0,1,0]=3 7801 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1C)O 62a_100011380479_100000033060 [0,2,0,0,0,0|0,1,0]=3 7802 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)Br 62a_100000033060_100011772130 [0,2,0,0,0,0|0,1,0]=3 7803 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)Br 62a_100011772130_100000033060 [0,2,0,0,0,0|0,1,0]=3 7804 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)C 62a_100000033060_100012356289 [0,2,0,0,0,0|0,1,0]=3 7805 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)C 62a_100012356289_100000033060 [0,2,0,0,0,0|0,1,0]=3 7806 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)Cl 62a_100000033060_100000707729 [0,2,0,0,0,0|0,1,0]=3 7807 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)Cl 62a_100000707729_100000033060 [0,2,0,0,0,0|0,1,0]=3 7808 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)F 62a_100000033060_100011217299 [0,2,0,0,0,0|0,1,0]=3 7809 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)F 62a_100011217299_100000033060 [0,2,0,0,0,0|0,1,0]=3 7810 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)N 62a_100000033060_100012360549 [0,2,0,0,0,0|0,1,0]=3 7811 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)N 62a_100012360549_100000033060 [0,2,0,0,0,0|0,1,0]=3 7812 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)O 62a_100000033060_100000049588 [0,2,0,0,0,0|0,1,0]=3 7813 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1Cl)O 62a_100000049588_100000033060 [0,2,0,0,0,0|0,1,0]=3 7814 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)Br 62a_100000033060_100011217312 [0,2,0,0,0,0|0,1,0]=3 7815 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)Br 62a_100011217312_100000033060 [0,2,0,0,0,0|0,1,0]=3 7816 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)C 62a_100000033060_100000736223 [0,2,0,0,0,0|0,1,0]=3 7817 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)C 62a_100000736223_100000033060 [0,2,0,0,0,0|0,1,0]=3 7818 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)Cl 62a_100000033060_100011218116 [0,2,0,0,0,0|0,1,0]=3 7819 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)Cl 62a_100011218116_100000033060 [0,2,0,0,0,0|0,1,0]=3 7820 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)F 62a_100000033060_100011219198 [0,2,0,0,0,0|0,1,0]=3 7821 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)F 62a_100011219198_100000033060 [0,2,0,0,0,0|0,1,0]=3 7822 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)N 62a_100000033060_100000760356 [0,2,0,0,0,0|0,1,0]=3 7823 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)N 62a_100000760356_100000033060 [0,2,0,0,0,0|0,1,0]=3 7824 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)O 62a_100000033060_100000693481 [0,2,0,0,0,0|0,1,0]=3 7825 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1F)O 62a_100000693481_100000033060 [0,2,0,0,0,0|0,1,0]=3 7826 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)Br 62a_100000033060_100000187925 [0,2,0,0,0,0|0,1,0]=3 7827 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)Br 62a_100000187925_100000033060 [0,2,0,0,0,0|0,1,0]=3 7828 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)C 62a_100000033060_100011356834 [0,2,0,0,0,0|0,1,0]=3 7829 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)C 62a_100011356834_100000033060 [0,2,0,0,0,0|0,1,0]=3 7830 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)Cl 62a_100000033060_100000761889 [0,2,0,0,0,0|0,1,0]=3 7831 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)Cl 62a_100000761889_100000033060 [0,2,0,0,0,0|0,1,0]=3 7832 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)F 62a_100000033060_100000760547 [0,2,0,0,0,0|0,1,0]=3 7833 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)F 62a_100000760547_100000033060 [0,2,0,0,0,0|0,1,0]=3 7834 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)N 62a_100000033060_100011534242 [0,2,0,0,0,0|0,1,0]=3 7835 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)N 62a_100011534242_100000033060 [0,2,0,0,0,0|0,1,0]=3 7836 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)O 62a_100000033060_100012001276 [0,2,0,0,0,0|0,1,0]=3 7837 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1N)O 62a_100012001276_100000033060 [0,2,0,0,0,0|0,1,0]=3 7838 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)Br 62a_100000033060_100012355227 [0,2,0,0,0,0|0,1,0]=3 7839 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)Br 62a_100012355227_100000033060 [0,2,0,0,0,0|0,1,0]=3 7840 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)C 62a_100000033060_100000765521 [0,2,0,0,0,0|0,1,0]=3 7841 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)C 62a_100000765521_100000033060 [0,2,0,0,0,0|0,1,0]=3 7842 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)Cl 62a_100000033060_100011356953 [0,2,0,0,0,0|0,1,0]=3 7843 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)Cl 62a_100011356953_100000033060 [0,2,0,0,0,0|0,1,0]=3 7844 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)F 62a_100000033060_100000211999 [0,2,0,0,0,0|0,1,0]=3 7845 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)F 62a_100000211999_100000033060 [0,2,0,0,0,0|0,1,0]=3 7846 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)N 62a_100000033060_100011534360 [0,2,0,0,0,0|0,1,0]=3 7847 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)N 62a_100011534360_100000033060 [0,2,0,0,0,0|0,1,0]=3 7848 B16R1.7334 C=CCOC(=O)CSc1cc(ccc1O)O 62a_100000033060_100009813629 [0,2,0,0,0,0|0,1,0]=3 7849 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Br)N 62a_100000033060_100010201102 [0,2,0,0,0,0|1,1,0]=4 7850 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Br)N 62a_100010201102_100000033060 [0,2,0,0,0,0|1,1,0]=4 7851 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)Br 62a_100000033060_200010090566 [0,2,0,0,0,0|1,1,0]=4 7852 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)Br 62a_200010090566_100000033060 [0,2,0,0,0,0|1,1,0]=4 7853 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)C 62a_100000033060_100009817436 [0,2,0,0,0,0|1,1,0]=4 7854 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)C 62a_100009817436_100000033060 [0,2,0,0,0,0|1,1,0]=4 7855 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)F 62a_100000033060_100009860710 [0,2,0,0,0,0|1,1,0]=4 7856 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)F 62a_100009860710_100000033060 [0,2,0,0,0,0|1,1,0]=4 7857 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)N 62a_100000033060_100011998591 [0,2,0,0,0,0|1,1,0]=4 7858 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)N 62a_100011998591_100000033060 [0,2,0,0,0,0|1,1,0]=4 7859 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)O 62a_100000033060_100009819603 [0,2,0,0,0,0|1,1,0]=4 7860 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1C)O 62a_100009819603_100000033060 [0,2,0,0,0,0|1,1,0]=4 7861 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)Br 62a_100000033060_100009814771 [0,2,0,0,0,0|1,1,0]=4 7862 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)Br 62a_100009814771_100000033060 [0,2,0,0,0,0|1,1,0]=4 7863 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)C 62a_100000033060_100010210167 [0,2,0,0,0,0|1,1,0]=4 7864 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)C 62a_100010210167_100000033060 [0,2,0,0,0,0|1,1,0]=4 7865 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)Cl 62a_100000033060_200000062399 [0,2,0,0,0,0|1,1,0]=4 7866 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)Cl 62a_200000062399_100000033060 [0,2,0,0,0,0|1,1,0]=4 7867 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)N 62a_100000033060_100010253917 [0,2,0,0,0,0|1,1,0]=4 7868 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1Cl)N 62a_100010253917_100000033060 [0,2,0,0,0,0|1,1,0]=4 7869 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)Br 62a_100000033060_100010172738 [0,2,0,0,0,0|1,1,0]=4 7870 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)Br 62a_100010172738_100000033060 [0,2,0,0,0,0|1,1,0]=4 7871 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)C 62a_100000033060_100000049784 [0,2,0,0,0,0|1,1,0]=4 7872 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)C 62a_100000049784_100000033060 [0,2,0,0,0,0|1,1,0]=4 7873 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)Cl 62a_100000033060_100010188783 [0,2,0,0,0,0|1,1,0]=4 7874 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)Cl 62a_100010188783_100000033060 [0,2,0,0,0,0|1,1,0]=4 7875 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)F 62a_100000033060_100009820768 [0,2,0,0,0,0|1,1,0]=4 7876 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)F 62a_100009820768_100000033060 [0,2,0,0,0,0|1,1,0]=4 7877 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)N 62a_100000033060_100009840397 [0,2,0,0,0,0|1,1,0]=4 7878 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)N 62a_100009840397_100000033060 [0,2,0,0,0,0|1,1,0]=4 7879 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)O 62a_100000033060_100009817267 [0,2,0,0,0,0|1,1,0]=4 7880 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1F)O 62a_100009817267_100000033060 [0,2,0,0,0,0|1,1,0]=4 7881 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)Br 62a_100000033060_100000760472 [0,2,0,0,0,0|1,1,0]=4 7882 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)Br 62a_100000760472_100000033060 [0,2,0,0,0,0|1,1,0]=4 7883 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)C 62a_100000033060_100000049664 [0,2,0,0,0,0|1,1,0]=4 7884 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)C 62a_100000049664_100000033060 [0,2,0,0,0,0|1,1,0]=4 7885 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)Cl 62a_100000033060_100000050159 [0,2,0,0,0,0|1,1,0]=4 7886 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)Cl 62a_100000050159_100000033060 [0,2,0,0,0,0|1,1,0]=4 7887 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)F 62a_100000033060_100009814671 [0,2,0,0,0,0|1,1,0]=4 7888 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)F 62a_100009814671_100000033060 [0,2,0,0,0,0|1,1,0]=4 7889 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)N 62a_100000033060_200011934315 [0,2,0,0,0,0|1,1,0]=4 7890 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1N)N 62a_200011934315_100000033060 [0,2,0,0,0,0|1,1,0]=4 7891 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)Br 62a_100000033060_100010197142 [0,2,0,0,0,0|1,1,0]=4 7892 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)Br 62a_100010197142_100000033060 [0,2,0,0,0,0|1,1,0]=4 7893 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)C 62a_100000033060_100000719714 [0,2,0,0,0,0|1,1,0]=4 7894 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)C 62a_100000719714_100000033060 [0,2,0,0,0,0|1,1,0]=4 7895 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)Cl 62a_100000033060_100010188700 [0,2,0,0,0,0|1,1,0]=4 7896 B16R1.7334 C=CCOC(=O)CSc1cc(cnc1O)Cl 62a_100010188700_100000033060 [0,2,0,0,0,0|1,1,0]=4 7897 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Br)Br 62a_100000033060_100010171693 [0,2,0,0,0,0|1,1,0]=4 7898 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Br)Br 62a_100010171693_100000033060 [0,2,0,0,0,0|1,1,0]=4 7899 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Br)Cl 62a_100000033060_100009815598 [0,2,0,0,0,0|1,1,0]=4 7900 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Br)Cl 62a_100009815598_100000033060 [0,2,0,0,0,0|1,1,0]=4 7901 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)Br 62a_100000033060_100010067628 [0,2,0,0,0,0|1,1,0]=4 7902 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)Br 62a_100010067628_100000033060 [0,2,0,0,0,0|1,1,0]=4 7903 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)C 62a_100000033060_100009862788 [0,2,0,0,0,0|1,1,0]=4 7904 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)C 62a_100009862788_100000033060 [0,2,0,0,0,0|1,1,0]=4 7905 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)Cl 62a_100000033060_100010068021 [0,2,0,0,0,0|1,1,0]=4 7906 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)Cl 62a_100010068021_100000033060 [0,2,0,0,0,0|1,1,0]=4 7907 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)F 62a_100000033060_100000049870 [0,2,0,0,0,0|1,1,0]=4 7908 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)F 62a_100000049870_100000033060 [0,2,0,0,0,0|1,1,0]=4 7909 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)N 62a_100000033060_100009819938 [0,2,0,0,0,0|1,1,0]=4 7910 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)N 62a_100009819938_100000033060 [0,2,0,0,0,0|1,1,0]=4 7911 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)O 62a_100000033060_100009831917 [0,2,0,0,0,0|1,1,0]=4 7912 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1C)O 62a_100009831917_100000033060 [0,2,0,0,0,0|1,1,0]=4 7913 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)Br 62a_100000033060_100010223331 [0,2,0,0,0,0|1,1,0]=4 7914 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)Br 62a_100010223331_100000033060 [0,2,0,0,0,0|1,1,0]=4 7915 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)Cl 62a_100000033060_100010172835 [0,2,0,0,0,0|1,1,0]=4 7916 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)Cl 62a_100010172835_100000033060 [0,2,0,0,0,0|1,1,0]=4 7917 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)F 62a_100000033060_100009892587 [0,2,0,0,0,0|1,1,0]=4 7918 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)F 62a_100009892587_100000033060 [0,2,0,0,0,0|1,1,0]=4 7919 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)N 62a_100000033060_100010134119 [0,2,0,0,0,0|1,1,0]=4 7920 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1Cl)N 62a_100010134119_100000033060 [0,2,0,0,0,0|1,1,0]=4 7921 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)Br 62a_100000033060_100010193852 [0,2,0,0,0,0|1,1,0]=4 7922 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)Br 62a_100010193852_100000033060 [0,2,0,0,0,0|1,1,0]=4 7923 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)C 62a_100000033060_100009867690 [0,2,0,0,0,0|1,1,0]=4 7924 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)C 62a_100009867690_100000033060 [0,2,0,0,0,0|1,1,0]=4 7925 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)Cl 62a_100000033060_100000708277 [0,2,0,0,0,0|1,1,0]=4 7926 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)Cl 62a_100000708277_100000033060 [0,2,0,0,0,0|1,1,0]=4 7927 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)F 62a_100000033060_100010233071 [0,2,0,0,0,0|1,1,0]=4 7928 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)F 62a_100010233071_100000033060 [0,2,0,0,0,0|1,1,0]=4 7929 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)N 62a_100000033060_100015713587 [0,2,0,0,0,0|1,1,0]=4 7930 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1F)N 62a_100015713587_100000033060 [0,2,0,0,0,0|1,1,0]=4 7931 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1N)Cl 62a_100000033060_100000050123 [0,2,0,0,0,0|1,1,0]=4 7932 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1N)Cl 62a_100000050123_100000033060 [0,2,0,0,0,0|1,1,0]=4 7933 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1O)C 62a_100000033060_100009843476 [0,2,0,0,0,0|1,1,0]=4 7934 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1O)C 62a_100009843476_100000033060 [0,2,0,0,0,0|1,1,0]=4 7935 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1O)Cl 62a_100000033060_100000698892 [0,2,0,0,0,0|1,1,0]=4 7936 B16R1.7334 C=CCOC(=O)CSc1cc(ncc1O)Cl 62a_100000698892_100000033060 [0,2,0,0,0,0|1,1,0]=4 7937 B16R1.7334 C=CCOC(=O)CSc1cn(ccc1=O)C 62a_100000033060_100010750718 [0,2,0,0,0,0|1,1,0]=4 7938 B16R1.7334 C=CCOC(=O)CSc1cn(ccc1=O)C 62a_100010750718_100000033060 [0,2,0,0,0,0|1,1,0]=4 7939 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1Br)N 62a_100000033060_100010192275 [0,2,0,0,0,0|1,1,0]=4 7940 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1Br)N 62a_100010192275_100000033060 [0,2,0,0,0,0|1,1,0]=4 7941 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1C)C 62a_100000033060_100009854376 [0,2,0,0,0,0|1,1,0]=4 7942 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1C)C 62a_100009854376_100000033060 [0,2,0,0,0,0|1,1,0]=4 7943 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1C)N 62a_100000033060_100000126722 [0,2,0,0,0,0|1,1,0]=4 7944 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1C)N 62a_100000126722_100000033060 [0,2,0,0,0,0|1,1,0]=4 7945 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)C 62a_100000033060_100009817602 [0,2,0,0,0,0|1,1,0]=4 7946 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)C 62a_100009817602_100000033060 [0,2,0,0,0,0|1,1,0]=4 7947 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)Cl 62a_100000033060_100010136221 [0,2,0,0,0,0|1,1,0]=4 7948 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)Cl 62a_100010136221_100000033060 [0,2,0,0,0,0|1,1,0]=4 7949 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)F 62a_100000033060_100010997973 [0,2,0,0,0,0|1,1,0]=4 7950 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)F 62a_100010997973_100000033060 [0,2,0,0,0,0|1,1,0]=4 7951 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)N 62a_100000033060_100010892222 [0,2,0,0,0,0|1,1,0]=4 7952 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1F)N 62a_100010892222_100000033060 [0,2,0,0,0,0|1,1,0]=4 7953 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)Br 62a_100000033060_100010168765 [0,2,0,0,0,0|1,1,0]=4 7954 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)Br 62a_100010168765_100000033060 [0,2,0,0,0,0|1,1,0]=4 7955 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)C 62a_100000033060_100000685570 [0,2,0,0,0,0|1,1,0]=4 7956 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)C 62a_100000685570_100000033060 [0,2,0,0,0,0|1,1,0]=4 7957 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)Cl 62a_100000033060_100010233647 [0,2,0,0,0,0|1,1,0]=4 7958 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)Cl 62a_100010233647_100000033060 [0,2,0,0,0,0|1,1,0]=4 7959 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)F 62a_100000033060_100009879877 [0,2,0,0,0,0|1,1,0]=4 7960 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)F 62a_100009879877_100000033060 [0,2,0,0,0,0|1,1,0]=4 7961 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)N 62a_100000033060_200009884323 [0,2,0,0,0,0|1,1,0]=4 7962 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1N)N 62a_200009884323_100000033060 [0,2,0,0,0,0|1,1,0]=4 7963 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)Br 62a_100000033060_100010253912 [0,2,0,0,0,0|1,1,0]=4 7964 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)Br 62a_100010253912_100000033060 [0,2,0,0,0,0|1,1,0]=4 7965 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)C 62a_100000033060_100000702858 [0,2,0,0,0,0|1,1,0]=4 7966 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)C 62a_100000702858_100000033060 [0,2,0,0,0,0|1,1,0]=4 7967 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)Cl 62a_100000033060_100000696390 [0,2,0,0,0,0|1,1,0]=4 7968 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)F 62a_100000033060_100010382442 [0,2,0,0,0,0|1,1,0]=4 7969 B16R1.7334 C=CCOC(=O)CSc1nc(ccc1O)F 62a_100010382442_100000033060 [0,2,0,0,0,0|1,1,0]=4 7970 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)Br 34a_100011220040_200011215008 [0,2,0,0,0,0|0,0,2]=4 7971 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)Br 7a_100011220040_200011215008 [0,2,0,0,0,0|0,0,2]=4 7972 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)C 34a_100012002257_200011215008 [0,2,0,0,0,0|0,0,2]=4 7973 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)C 7a_100012002257_200011215008 [0,2,0,0,0,0|0,0,2]=4 7974 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)Cl 34a_100012339455_200011215008 [0,2,0,0,0,0|0,0,2]=4 7975 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)Cl 7a_100012339455_200011215008 [0,2,0,0,0,0|0,0,2]=4 7976 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)F 34a_100000690578_200011215008 [0,2,0,0,0,0|0,0,2]=4 7977 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)F 7a_100000690578_200011215008 [0,2,0,0,0,0|0,0,2]=4 7978 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)I 34a_100012356990_200011215008 [0,2,0,0,0,0|0,0,2]=4 7979 B16R1.7334 CCCOC(=O)COc1cc(ccc1Br)I 7a_100012356990_200011215008 [0,2,0,0,0,0|0,0,2]=4 7980 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)Br 34a_100000685420_200011215008 [0,2,0,0,0,0|0,0,2]=4 7981 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)Br 7a_100000685420_200011215008 [0,2,0,0,0,0|0,0,2]=4 7982 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)C 34a_100000210931_200011215008 [0,2,0,0,0,0|0,0,2]=4 7983 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)C 7a_100000210931_200011215008 [0,2,0,0,0,0|0,0,2]=4 7984 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)Cl 34a_100000756515_200011215008 [0,2,0,0,0,0|0,0,2]=4 7985 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)Cl 7a_100000756515_200011215008 [0,2,0,0,0,0|0,0,2]=4 7986 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)F 34a_100000690566_200011215008 [0,2,0,0,0,0|0,0,2]=4 7987 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)F 7a_100000690566_200011215008 [0,2,0,0,0,0|0,0,2]=4 7988 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)I 7a_100000766334_200011215008 [0,2,0,0,0,0|0,0,2]=4 7989 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)N 34a_100000759471_200011215008 [0,2,0,0,0,0|0,0,2]=4 7990 B16R1.7334 CCCOC(=O)COc1cc(ccc1C)N 7a_100000759471_200011215008 [0,2,0,0,0,0|0,0,2]=4 7991 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)Br 34a_100000738945_200011215008 [0,2,0,0,0,0|0,0,2]=4 7992 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)Br 7a_100000738945_200011215008 [0,2,0,0,0,0|0,0,2]=4 7993 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)C 34a_100000211493_200011215008 [0,2,0,0,0,0|0,0,2]=4 7994 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)C 7a_100000211493_200011215008 [0,2,0,0,0,0|0,0,2]=4 7995 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)Cl 34a_100000211422_200011215008 [0,2,0,0,0,0|0,0,2]=4 7996 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)Cl 7a_100000211422_200011215008 [0,2,0,0,0,0|0,0,2]=4 7997 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)F 34a_100000692107_200011215008 [0,2,0,0,0,0|0,0,2]=4 7998 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)F 7a_100000692107_200011215008 [0,2,0,0,0,0|0,0,2]=4 7999 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)I 34a_100011356854_200011215008 [0,2,0,0,0,0|0,0,2]=4 8000 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)I 7a_100011356854_200011215008 [0,2,0,0,0,0|0,0,2]=4 8001 B16R1.7334 CCCOC(=O)COc1cc(ccc1Cl)N 34a_100011934209_200011215008 [0,2,0,0,0,0|0,0,2]=4 8002 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)Br 34a_100000686035_200011215008 [0,2,0,0,0,0|0,0,2]=4 8003 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)Br 7a_100000686035_200011215008 [0,2,0,0,0,0|0,0,2]=4 8004 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)C 34a_100000759540_200011215008 [0,2,0,0,0,0|0,0,2]=4 8005 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)C 7a_100000759540_200011215008 [0,2,0,0,0,0|0,0,2]=4 8006 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)Cl 34a_100000757397_200011215008 [0,2,0,0,0,0|0,0,2]=4 8007 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)Cl 7a_100000757397_200011215008 [0,2,0,0,0,0|0,0,2]=4 8008 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)F 34a_100000752141_200011215008 [0,2,0,0,0,0|0,0,2]=4 8009 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)F 7a_100000752141_200011215008 [0,2,0,0,0,0|0,0,2]=4 8010 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)I 34a_100009958187_200011215008 [0,2,0,0,0,0|0,0,2]=4 8011 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)I 7a_100009958187_200011215008 [0,2,0,0,0,0|0,0,2]=4 8012 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)N 34a_100012017398_200011215008 [0,2,0,0,0,0|0,0,2]=4 8013 B16R1.7334 CCCOC(=O)COc1cc(ccc1F)N 7a_100012017398_200011215008 [0,2,0,0,0,0|0,0,2]=4 8014 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)Br 34a_100012344904_200011215008 [0,2,0,0,0,0|0,0,2]=4 8015 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)Br 7a_100012344904_200011215008 [0,2,0,0,0,0|0,0,2]=4 8016 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)Cl 34a_100000050036_200011215008 [0,2,0,0,0,0|0,0,2]=4 8017 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)Cl 7a_100000050036_200011215008 [0,2,0,0,0,0|0,0,2]=4 8018 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)F 34a_100010084537_200011215008 [0,2,0,0,0,0|0,0,2]=4 8019 B16R1.7334 CCCOC(=O)COc1cc(ccc1I)F 7a_100010084537_200011215008 [0,2,0,0,0,0|0,0,2]=4 8020 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)Br 34a_100000739049_200011215008 [0,2,0,0,0,0|0,0,2]=4 8021 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)Br 7a_100000739049_200011215008 [0,2,0,0,0,0|0,0,2]=4 8022 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)C 34a_100000211527_200011215008 [0,2,0,0,0,0|0,0,2]=4 8023 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)C 7a_100000211527_200011215008 [0,2,0,0,0,0|0,0,2]=4 8024 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)Cl 34a_100000185728_200011215008 [0,2,0,0,0,0|0,0,2]=4 8025 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)Cl 7a_100000185728_200011215008 [0,2,0,0,0,0|0,0,2]=4 8026 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)F 34a_100000753323_200011215008 [0,2,0,0,0,0|0,0,2]=4 8027 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)F 7a_100000753323_200011215008 [0,2,0,0,0,0|0,0,2]=4 8028 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)I 34a_100000057187_200011215008 [0,2,0,0,0,0|0,0,2]=4 8029 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)I 7a_100000057187_200011215008 [0,2,0,0,0,0|0,0,2]=4 8030 B16R1.7334 CCCOC(=O)COc1cc(ccc1N)N 34a_100025717382_200011215008 [0,2,0,0,0,0|0,0,2]=4 8031 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)Br)Br 1458a_100010253072_100000754431 [0,2,0,0,0,0|2,0,0]=4 8032 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)Br)F 1458a_100012357547_100000754431 [0,2,0,0,0,0|2,0,0]=4 8033 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)C)C 1458a_100000688337_100000754431 [0,2,0,0,0,0|2,0,0]=4 8034 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000689174_100000754431 [0,2,0,0,0,0|2,0,0]=4 8035 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000749702_100000691793 [0,2,0,0,0,0|2,0,0]=4 8036 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)F)F 1458a_100000749702_100011754442 [0,2,0,0,0,0|2,0,0]=4 8037 B16R1.7629 C=CCCC(=O)CCc1cc(cc(c1)F)F 1458a_100011934504_100000754431 [0,2,0,0,0,0|2,0,0]=4 8038 B16R1.7629 C=CCCC(=O)COc1cc(cc(c1)Br)Cl 1458a_100010899942_100000754431 [0,2,0,0,0,0|1,0,0]=3 8039 B16R1.7629 C=CCCC(=O)COc1cc(cc(c1)C)C 1458a_100000182991_100000754431 [0,2,0,0,0,0|1,0,0]=3 8040 B16R1.7629 C=CCCC(=O)COc1cc(cc(c1)Cl)Cl 1458a_100000764634_100000754431 [0,2,0,0,0,0|1,0,0]=3 8041 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)Br 1626a_100020586998_100010253072 [0,2,0,0,0,0|2,0,0]=4 8042 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)Br 240690a_100020586998_100010253072 [0,2,0,0,0,0|2,0,0]=4 8043 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)Br 527a_100020586998_100010253072 [0,2,0,0,0,0|2,0,0]=4 8044 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)F 1626a_100020586998_100012357547 [0,2,0,0,0,0|2,0,0]=4 8045 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)F 240690a_100020586998_100012357547 [0,2,0,0,0,0|2,0,0]=4 8046 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Br)F 527a_100020586998_100012357547 [0,2,0,0,0,0|2,0,0]=4 8047 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)C)C 1626a_100020586998_100000688337 [0,2,0,0,0,0|2,0,0]=4 8048 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)C)C 240690a_100020586998_100000688337 [0,2,0,0,0,0|2,0,0]=4 8049 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)C)C 527a_100020586998_100000688337 [0,2,0,0,0,0|2,0,0]=4 8050 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Cl)Cl 1626a_100020586998_100000689174 [0,2,0,0,0,0|2,0,0]=4 8051 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Cl)Cl 240690a_100020586998_100000689174 [0,2,0,0,0,0|2,0,0]=4 8052 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)Cl)Cl 527a_100020586998_100000689174 [0,2,0,0,0,0|2,0,0]=4 8053 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)F)F 1626a_100020586998_100011934504 [0,2,0,0,0,0|2,0,0]=4 8054 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)F)F 240690a_100020586998_100011934504 [0,2,0,0,0,0|2,0,0]=4 8055 B16R1.7629 C=CCNC(=O)CCc1cc(cc(c1)F)F 527a_100020586998_100011934504 [0,2,0,0,0,0|2,0,0]=4 8056 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Br)Br 7a_100012047176_100000183597 [0,2,0,0,0,0|2,0,0]=4 8057 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Br)C 7a_100000695972_100000183597 [0,2,0,0,0,0|2,0,0]=4 8058 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Br)Cl 7a_100011934539_100000183597 [0,2,0,0,0,0|2,0,0]=4 8059 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Br)F 7a_100000705686_100000183597 [0,2,0,0,0,0|2,0,0]=4 8060 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)C)C 2230a_100000210930_100000183597 [0,2,0,0,0,0|2,0,0]=4 8061 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)C)C 7a_100000210930_100000183597 [0,2,0,0,0,0|2,0,0]=4 8062 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Cl)C 2230a_100012022512_100000183597 [0,2,0,0,0,0|2,0,0]=4 8063 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Cl)C 7a_100012022512_100000183597 [0,2,0,0,0,0|2,0,0]=4 8064 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Cl)Cl 7a_100000210456_100000183597 [0,2,0,0,0,0|2,0,0]=4 8065 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Cl)F 7a_100000686136_100000183597 [0,2,0,0,0,0|2,0,0]=4 8066 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000183597 [0,2,0,0,0,0|2,0,0]=4 8067 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)F)C 2230a_100000742734_100000183597 [0,2,0,0,0,0|2,0,0]=4 8068 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)F)C 7a_100000742734_100000183597 [0,2,0,0,0,0|2,0,0]=4 8069 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)F)F 7a_100000233717_100000183597 [0,2,0,0,0,0|2,0,0]=4 8070 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)I)Br 7a_100009814763_100000183597 [0,2,0,0,0,0|2,0,0]=4 8071 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)I)Cl 7a_100010147676_100000183597 [0,2,0,0,0,0|2,0,0]=4 8072 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)I)F 7a_100011356972_100000183597 [0,2,0,0,0,0|2,0,0]=4 8073 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)I)I 7a_200000696836_100000183597 [0,2,0,0,0,0|2,0,0]=4 8074 B16R1.7629 C=CCNC(=O)CNc1cc(cc(c1)O)C 7a_100011995906_100000183597 [0,2,0,0,0,0|2,0,0]=4 8075 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)Br 7a_100010167048_100000183597 [0,2,0,0,0,0|1,0,0]=3 8076 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)C 7a_100011999630_100000183597 [0,2,0,0,0,0|1,0,0]=3 8077 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)Cl 1626a_100020586998_100010899942 [0,2,0,0,0,0|1,0,0]=3 8078 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)Cl 240690a_100020586998_100010899942 [0,2,0,0,0,0|1,0,0]=3 8079 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)Cl 527a_100020586998_100010899942 [0,2,0,0,0,0|1,0,0]=3 8080 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000183597 [0,2,0,0,0,0|1,0,0]=3 8081 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Br)F 7a_100000688818_100000183597 [0,2,0,0,0,0|1,0,0]=3 8082 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)C)C 1626a_100020586998_100000182991 [0,2,0,0,0,0|1,0,0]=3 8083 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)C)C 240690a_100020586998_100000182991 [0,2,0,0,0,0|1,0,0]=3 8084 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)C)C 527a_100020586998_100000182991 [0,2,0,0,0,0|1,0,0]=3 8085 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)C)C 7a_100000210933_100000183597 [0,2,0,0,0,0|1,0,0]=3 8086 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)C 7a_100000087485_100000183597 [0,2,0,0,0,0|1,0,0]=3 8087 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)Cl 1626a_100020586998_100000764634 [0,2,0,0,0,0|1,0,0]=3 8088 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)Cl 240690a_100020586998_100000764634 [0,2,0,0,0,0|1,0,0]=3 8089 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)Cl 527a_100020586998_100000764634 [0,2,0,0,0,0|1,0,0]=3 8090 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000183597 [0,2,0,0,0,0|1,0,0]=3 8091 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)F 7a_100011219751_100000183597 [0,2,0,0,0,0|1,0,0]=3 8092 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)Cl)N 7a_100000123917_100000183597 [0,2,0,0,0,0|1,0,0]=3 8093 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)F)C 7a_100011830401_100000183597 [0,2,0,0,0,0|1,0,0]=3 8094 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)F)F 7a_100000747503_100000183597 [0,2,0,0,0,0|1,0,0]=3 8095 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)I)Br 7a_100010068917_100000183597 [0,2,0,0,0,0|1,0,0]=3 8096 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)I)Cl 7a_100010068924_100000183597 [0,2,0,0,0,0|1,0,0]=3 8097 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)I)F 7a_100000717995_100000183597 [0,2,0,0,0,0|1,0,0]=3 8098 B16R1.7629 C=CCNC(=O)COc1cc(cc(c1)N)C 7a_100011995906_100000183597 [0,2,0,0,0,0|1,0,0]=3 8099 B16R1.7629 C=CCNC(=O)COc1cc(nc(c1)Br)Br 7a_100010172823_100000183597 [0,2,0,0,0,0|2,0,0]=4 8100 B16R1.7629 C=CCNC(=O)COc1cc(oc(=O)c1)C 7a_100000210952_100000183597 [0,2,0,0,0,0|2,0,0]=4 8101 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)Br 62a_100000183597_100009814770 [0,2,0,0,0,0|1,1,0]=4 8102 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)Br 62a_100009814770_100000183597 [0,2,0,0,0,0|1,1,0]=4 8103 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)Cl 62a_100000183597_100009814755 [0,2,0,0,0,0|1,1,0]=4 8104 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)Cl 62a_100009814755_100000183597 [0,2,0,0,0,0|1,1,0]=4 8105 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)F 62a_100000183597_100009814764 [0,2,0,0,0,0|1,1,0]=4 8106 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)F 62a_100009814764_100000183597 [0,2,0,0,0,0|1,1,0]=4 8107 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)N 62a_100000183597_100009814763 [0,2,0,0,0,0|1,1,0]=4 8108 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)N 62a_100009814763_100000183597 [0,2,0,0,0,0|1,1,0]=4 8109 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)O 62a_100000183597_100010068917 [0,2,0,0,0,0|1,1,0]=4 8110 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Br)O 62a_100010068917_100000183597 [0,2,0,0,0,0|1,1,0]=4 8111 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)C)C 62a_100000183597_100011215608 [0,2,0,0,0,0|1,1,0]=4 8112 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)C)C 62a_100011215608_100000183597 [0,2,0,0,0,0|1,1,0]=4 8113 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)C 62a_100000183597_100010172791 [0,2,0,0,0,0|1,1,0]=4 8114 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)C 62a_100010172791_100000183597 [0,2,0,0,0,0|1,1,0]=4 8115 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)Cl 62a_100000183597_100000747138 [0,2,0,0,0,0|1,1,0]=4 8116 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)Cl 62a_100000747138_100000183597 [0,2,0,0,0,0|1,1,0]=4 8117 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)F 62a_100000183597_100013859453 [0,2,0,0,0,0|1,1,0]=4 8118 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)F 62a_100013859453_100000183597 [0,2,0,0,0,0|1,1,0]=4 8119 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)N 62a_100000183597_100010147676 [0,2,0,0,0,0|1,1,0]=4 8120 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)N 62a_100010147676_100000183597 [0,2,0,0,0,0|1,1,0]=4 8121 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)O 62a_100000183597_100010068924 [0,2,0,0,0,0|1,1,0]=4 8122 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000183597 [0,2,0,0,0,0|1,1,0]=4 8123 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)C 62a_100000183597_100011356977 [0,2,0,0,0,0|1,1,0]=4 8124 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)C 62a_100011356977_100000183597 [0,2,0,0,0,0|1,1,0]=4 8125 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)F 62a_100000183597_100000233788 [0,2,0,0,0,0|1,1,0]=4 8126 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)F 62a_100000233788_100000183597 [0,2,0,0,0,0|1,1,0]=4 8127 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)N 62a_100000183597_100011356972 [0,2,0,0,0,0|1,1,0]=4 8128 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)N 62a_100011356972_100000183597 [0,2,0,0,0,0|1,1,0]=4 8129 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)O 62a_100000183597_100000688818 [0,2,0,0,0,0|1,1,0]=4 8130 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)F)O 62a_100000688818_100000183597 [0,2,0,0,0,0|1,1,0]=4 8131 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)N)C 62a_100000183597_100000695972 [0,2,0,0,0,0|1,1,0]=4 8132 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)N)C 62a_100000695972_100000183597 [0,2,0,0,0,0|1,1,0]=4 8133 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)N)N 62a_100000183597_100011999608 [0,2,0,0,0,0|1,1,0]=4 8134 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)N)N 62a_100011999608_100000183597 [0,2,0,0,0,0|1,1,0]=4 8135 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)O)C 62a_100000183597_100011999630 [0,2,0,0,0,0|1,1,0]=4 8136 B16R1.7629 C=CCNC(=O)CSc1cc(cc(c1)O)O 62a_100000183597_100009868816 [0,2,0,0,0,0|1,1,0]=4 8137 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)Br 34a_100012047176_100000033060 [0,2,0,0,0,0|1,0,0]=3 8138 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)Br 7a_100012047176_100000033060 [0,2,0,0,0,0|1,0,0]=3 8139 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)C 34a_100000695972_100000033060 [0,2,0,0,0,0|1,0,0]=3 8140 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)C 7a_100000695972_100000033060 [0,2,0,0,0,0|1,0,0]=3 8141 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)Cl 34a_100011934539_100000033060 [0,2,0,0,0,0|1,0,0]=3 8142 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)Cl 7a_100011934539_100000033060 [0,2,0,0,0,0|1,0,0]=3 8143 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)F 34a_100000705686_100000033060 [0,2,0,0,0,0|1,0,0]=3 8144 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Br)F 7a_100000705686_100000033060 [0,2,0,0,0,0|1,0,0]=3 8145 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)C)C 2230a_100000210930_100000033060 [0,2,0,0,0,0|1,0,0]=3 8146 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)C)C 34a_100000210930_100000033060 [0,2,0,0,0,0|1,0,0]=3 8147 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)C)C 7a_100000210930_100000033060 [0,2,0,0,0,0|1,0,0]=3 8148 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)C 2230a_100012022512_100000033060 [0,2,0,0,0,0|1,0,0]=3 8149 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)C 34a_100012022512_100000033060 [0,2,0,0,0,0|1,0,0]=3 8150 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)C 7a_100012022512_100000033060 [0,2,0,0,0,0|1,0,0]=3 8151 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)Cl 34a_100000210456_100000033060 [0,2,0,0,0,0|1,0,0]=3 8152 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)Cl 7a_100000210456_100000033060 [0,2,0,0,0,0|1,0,0]=3 8153 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)F 34a_100000686136_100000033060 [0,2,0,0,0,0|1,0,0]=3 8154 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)F 7a_100000686136_100000033060 [0,2,0,0,0,0|1,0,0]=3 8155 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)O 34a_100000123917_100000033060 [0,2,0,0,0,0|1,0,0]=3 8156 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000033060 [0,2,0,0,0,0|1,0,0]=3 8157 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)F)C 2230a_100000742734_100000033060 [0,2,0,0,0,0|1,0,0]=3 8158 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)F)C 34a_100000742734_100000033060 [0,2,0,0,0,0|1,0,0]=3 8159 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)F)C 7a_100000742734_100000033060 [0,2,0,0,0,0|1,0,0]=3 8160 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)F)F 34a_100000233717_100000033060 [0,2,0,0,0,0|1,0,0]=3 8161 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)F)F 7a_100000233717_100000033060 [0,2,0,0,0,0|1,0,0]=3 8162 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)I)Br 7a_100009814763_100000033060 [0,2,0,0,0,0|1,0,0]=3 8163 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)I)Cl 7a_100010147676_100000033060 [0,2,0,0,0,0|1,0,0]=3 8164 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)I)F 34a_100011356972_100000033060 [0,2,0,0,0,0|1,0,0]=3 8165 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)I)F 7a_100011356972_100000033060 [0,2,0,0,0,0|1,0,0]=3 8166 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)I)I 7a_200000696836_100000033060 [0,2,0,0,0,0|1,0,0]=3 8167 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)O)C 34a_100011995906_100000033060 [0,2,0,0,0,0|1,0,0]=3 8168 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)O)C 7a_100011995906_100000033060 [0,2,0,0,0,0|1,0,0]=3 8169 B16R1.7629 C=CCOC(=O)CNc1cc(cc(c1)O)O 34a_100000043371_100000033060 [0,2,0,0,0,0|1,0,0]=3 8170 B16R1.7629 C=CCOC(=O)COc1cc(=O)cc(o1)C 34a_100016989201_100000033060 [0,2,0,0,0,0|1,0,0]=3 8171 B16R1.7629 C=CCOC(=O)COc1cc([nH]c(=O)c1)C 34a_100000039070_100000033060 [0,2,0,0,0,0|1,0,0]=3 8172 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)Br 34a_100010167048_100000033060 [0,2,0,0,0,0|0,0,0]=2 8173 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)Br 7a_100010167048_100000033060 [0,2,0,0,0,0|0,0,0]=2 8174 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)C 34a_100011999630_100000033060 [0,2,0,0,0,0|0,0,0]=2 8175 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)C 7a_100011999630_100000033060 [0,2,0,0,0,0|0,0,0]=2 8176 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)Cl 34a_100010185897_100000033060 [0,2,0,0,0,0|0,0,0]=2 8177 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000033060 [0,2,0,0,0,0|0,0,0]=2 8178 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)F 34a_100000688818_100000033060 [0,2,0,0,0,0|0,0,0]=2 8179 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Br)F 7a_100000688818_100000033060 [0,2,0,0,0,0|0,0,0]=2 8180 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)C)C 34a_100000210933_100000033060 [0,2,0,0,0,0|0,0,0]=2 8181 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)C)C 7a_100000210933_100000033060 [0,2,0,0,0,0|0,0,0]=2 8182 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)C 34a_100000087485_100000033060 [0,2,0,0,0,0|0,0,0]=2 8183 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)C 7a_100000087485_100000033060 [0,2,0,0,0,0|0,0,0]=2 8184 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)Cl 34a_100000181315_100000033060 [0,2,0,0,0,0|0,0,0]=2 8185 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000033060 [0,2,0,0,0,0|0,0,0]=2 8186 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)F 34a_100011219751_100000033060 [0,2,0,0,0,0|0,0,0]=2 8187 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)F 7a_100011219751_100000033060 [0,2,0,0,0,0|0,0,0]=2 8188 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)N 34a_100000123917_100000033060 [0,2,0,0,0,0|0,0,0]=2 8189 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)Cl)N 7a_100000123917_100000033060 [0,2,0,0,0,0|0,0,0]=2 8190 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)F)C 34a_100011830401_100000033060 [0,2,0,0,0,0|0,0,0]=2 8191 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)F)C 7a_100011830401_100000033060 [0,2,0,0,0,0|0,0,0]=2 8192 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)F)F 34a_100000747503_100000033060 [0,2,0,0,0,0|0,0,0]=2 8193 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)F)F 7a_100000747503_100000033060 [0,2,0,0,0,0|0,0,0]=2 8194 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)Br 34a_100010068917_100000033060 [0,2,0,0,0,0|0,0,0]=2 8195 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)Br 7a_100010068917_100000033060 [0,2,0,0,0,0|0,0,0]=2 8196 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)Cl 34a_100010068924_100000033060 [0,2,0,0,0,0|0,0,0]=2 8197 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)Cl 7a_100010068924_100000033060 [0,2,0,0,0,0|0,0,0]=2 8198 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)F 34a_100000717995_100000033060 [0,2,0,0,0,0|0,0,0]=2 8199 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)I)F 7a_100000717995_100000033060 [0,2,0,0,0,0|0,0,0]=2 8200 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)N)C 34a_100011995906_100000033060 [0,2,0,0,0,0|0,0,0]=2 8201 B16R1.7629 C=CCOC(=O)COc1cc(cc(c1)N)C 7a_100011995906_100000033060 [0,2,0,0,0,0|0,0,0]=2 8202 B16R1.7629 C=CCOC(=O)COc1cc(nc(c1)Br)Br 34a_100010172823_100000033060 [0,2,0,0,0,0|1,0,0]=3 8203 B16R1.7629 C=CCOC(=O)COc1cc(nc(c1)Br)Br 7a_100010172823_100000033060 [0,2,0,0,0,0|1,0,0]=3 8204 B16R1.7629 C=CCOC(=O)COc1cc(oc(=O)c1)C 34a_100000210952_100000033060 [0,2,0,0,0,0|1,0,0]=3 8205 B16R1.7629 C=CCOC(=O)COc1cc(oc(=O)c1)C 7a_100000210952_100000033060 [0,2,0,0,0,0|1,0,0]=3 8206 B16R1.7629 C=CCOC(=O)CSc1cc([nH]c(=O)c1)C 62a_100000033060_100009861981 [0,2,0,0,0,0|1,1,0]=4 8207 B16R1.7629 C=CCOC(=O)CSc1cc([nH]c(=O)c1)C 62a_100009861981_100000033060 [0,2,0,0,0,0|1,1,0]=4 8208 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)Br 62a_100000033060_100009814770 [0,2,0,0,0,0|0,1,0]=3 8209 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)Br 62a_100009814770_100000033060 [0,2,0,0,0,0|0,1,0]=3 8210 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)Cl 62a_100000033060_100009814755 [0,2,0,0,0,0|0,1,0]=3 8211 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)Cl 62a_100009814755_100000033060 [0,2,0,0,0,0|0,1,0]=3 8212 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)F 62a_100000033060_100009814764 [0,2,0,0,0,0|0,1,0]=3 8213 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)F 62a_100009814764_100000033060 [0,2,0,0,0,0|0,1,0]=3 8214 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)N 62a_100000033060_100009814763 [0,2,0,0,0,0|0,1,0]=3 8215 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)N 62a_100009814763_100000033060 [0,2,0,0,0,0|0,1,0]=3 8216 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)O 62a_100000033060_100010068917 [0,2,0,0,0,0|0,1,0]=3 8217 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Br)O 62a_100010068917_100000033060 [0,2,0,0,0,0|0,1,0]=3 8218 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)C)C 62a_100000033060_100011215608 [0,2,0,0,0,0|0,1,0]=3 8219 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)C)C 62a_100011215608_100000033060 [0,2,0,0,0,0|0,1,0]=3 8220 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)C 62a_100000033060_100010172791 [0,2,0,0,0,0|0,1,0]=3 8221 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)C 62a_100010172791_100000033060 [0,2,0,0,0,0|0,1,0]=3 8222 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)Cl 62a_100000033060_100000747138 [0,2,0,0,0,0|0,1,0]=3 8223 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)Cl 62a_100000747138_100000033060 [0,2,0,0,0,0|0,1,0]=3 8224 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)F 62a_100000033060_100013859453 [0,2,0,0,0,0|0,1,0]=3 8225 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)F 62a_100013859453_100000033060 [0,2,0,0,0,0|0,1,0]=3 8226 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)N 62a_100000033060_100010147676 [0,2,0,0,0,0|0,1,0]=3 8227 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)N 62a_100010147676_100000033060 [0,2,0,0,0,0|0,1,0]=3 8228 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)O 62a_100000033060_100010068924 [0,2,0,0,0,0|0,1,0]=3 8229 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000033060 [0,2,0,0,0,0|0,1,0]=3 8230 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)C 62a_100000033060_100011356977 [0,2,0,0,0,0|0,1,0]=3 8231 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)C 62a_100011356977_100000033060 [0,2,0,0,0,0|0,1,0]=3 8232 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)F 62a_100000033060_100000233788 [0,2,0,0,0,0|0,1,0]=3 8233 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)F 62a_100000233788_100000033060 [0,2,0,0,0,0|0,1,0]=3 8234 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)N 62a_100000033060_100011356972 [0,2,0,0,0,0|0,1,0]=3 8235 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)N 62a_100011356972_100000033060 [0,2,0,0,0,0|0,1,0]=3 8236 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)O 62a_100000033060_100000688818 [0,2,0,0,0,0|0,1,0]=3 8237 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)F)O 62a_100000688818_100000033060 [0,2,0,0,0,0|0,1,0]=3 8238 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)N)C 62a_100000033060_100000695972 [0,2,0,0,0,0|0,1,0]=3 8239 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)N)C 62a_100000695972_100000033060 [0,2,0,0,0,0|0,1,0]=3 8240 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)N)N 62a_100000033060_100011999608 [0,2,0,0,0,0|0,1,0]=3 8241 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)N)N 62a_100011999608_100000033060 [0,2,0,0,0,0|0,1,0]=3 8242 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)O)C 62a_100000033060_100011999630 [0,2,0,0,0,0|0,1,0]=3 8243 B16R1.7629 C=CCOC(=O)CSc1cc(cc(c1)O)O 62a_100000033060_100009868816 [0,2,0,0,0,0|0,1,0]=3 8244 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)C)C 62a_100000033060_100000069240 [0,2,0,0,0,0|1,1,0]=4 8245 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)C)C 62a_100000069240_100000033060 [0,2,0,0,0,0|1,1,0]=4 8246 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)C)N 62a_100000033060_100000071261 [0,2,0,0,0,0|1,1,0]=4 8247 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)C)N 62a_100000071261_100000033060 [0,2,0,0,0,0|1,1,0]=4 8248 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)F)C 62a_100000033060_100009819601 [0,2,0,0,0,0|1,1,0]=4 8249 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)F)C 62a_100009819601_100000033060 [0,2,0,0,0,0|1,1,0]=4 8250 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)N)C 62a_100000033060_100009819863 [0,2,0,0,0,0|1,1,0]=4 8251 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)N)C 62a_100009819863_100000033060 [0,2,0,0,0,0|1,1,0]=4 8252 B16R1.7629 C=CCOC(=O)CSc1cc(cc(n1)O)N 62a_100000033060_200012179554 [0,2,0,0,0,0|1,1,0]=4 8253 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)C)C 62a_100000033060_100000066820 [0,2,0,0,0,0|1,1,0]=4 8254 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)C)C 62a_100000066820_100000033060 [0,2,0,0,0,0|1,1,0]=4 8255 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)C 62a_100000033060_100010068023 [0,2,0,0,0,0|1,1,0]=4 8256 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)C 62a_100010068023_100000033060 [0,2,0,0,0,0|1,1,0]=4 8257 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)Cl 62a_100000033060_100000062418 [0,2,0,0,0,0|1,1,0]=4 8258 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)Cl 62a_100000062418_100000033060 [0,2,0,0,0,0|1,1,0]=4 8259 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)F 62a_100000033060_100011069727 [0,2,0,0,0,0|1,1,0]=4 8260 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)F 62a_100011069727_100000033060 [0,2,0,0,0,0|1,1,0]=4 8261 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)N 62a_100000033060_200011084131 [0,2,0,0,0,0|1,1,0]=4 8262 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)Cl)N 62a_200011084131_100000033060 [0,2,0,0,0,0|1,1,0]=4 8263 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)F)C 62a_100000033060_100010006595 [0,2,0,0,0,0|1,1,0]=4 8264 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)F)C 62a_100010006595_100000033060 [0,2,0,0,0,0|1,1,0]=4 8265 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)F)F 62a_100000033060_100000049587 [0,2,0,0,0,0|1,1,0]=4 8266 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)F)F 62a_100000049587_100000033060 [0,2,0,0,0,0|1,1,0]=4 8267 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)N)C 62a_100000033060_100000076705 [0,2,0,0,0,0|1,1,0]=4 8268 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)N)C 62a_100000076705_100000033060 [0,2,0,0,0,0|1,1,0]=4 8269 B16R1.7629 C=CCOC(=O)CSc1cc(nc(c1)N)N 62a_100009816676_100000033060 [0,2,0,0,0,0|1,1,0]=4 8270 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)Br 34a_100010167048_200011215008 [0,2,0,0,0,0|0,0,2]=4 8271 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)Br 7a_100010167048_200011215008 [0,2,0,0,0,0|0,0,2]=4 8272 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)C 34a_100011999630_200011215008 [0,2,0,0,0,0|0,0,2]=4 8273 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)C 7a_100011999630_200011215008 [0,2,0,0,0,0|0,0,2]=4 8274 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)Cl 34a_100010185897_200011215008 [0,2,0,0,0,0|0,0,2]=4 8275 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)Cl 7a_100010185897_200011215008 [0,2,0,0,0,0|0,0,2]=4 8276 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)F 34a_100000688818_200011215008 [0,2,0,0,0,0|0,0,2]=4 8277 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Br)F 7a_100000688818_200011215008 [0,2,0,0,0,0|0,0,2]=4 8278 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)C)C 34a_100000210933_200011215008 [0,2,0,0,0,0|0,0,2]=4 8279 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)C)C 7a_100000210933_200011215008 [0,2,0,0,0,0|0,0,2]=4 8280 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)C 34a_100000087485_200011215008 [0,2,0,0,0,0|0,0,2]=4 8281 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)C 7a_100000087485_200011215008 [0,2,0,0,0,0|0,0,2]=4 8282 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)Cl 34a_100000181315_200011215008 [0,2,0,0,0,0|0,0,2]=4 8283 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)Cl 7a_100000181315_200011215008 [0,2,0,0,0,0|0,0,2]=4 8284 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)F 34a_100011219751_200011215008 [0,2,0,0,0,0|0,0,2]=4 8285 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)F 7a_100011219751_200011215008 [0,2,0,0,0,0|0,0,2]=4 8286 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)N 34a_100000123917_200011215008 [0,2,0,0,0,0|0,0,2]=4 8287 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)Cl)N 7a_100000123917_200011215008 [0,2,0,0,0,0|0,0,2]=4 8288 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)F)C 34a_100011830401_200011215008 [0,2,0,0,0,0|0,0,2]=4 8289 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)F)C 7a_100011830401_200011215008 [0,2,0,0,0,0|0,0,2]=4 8290 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)F)F 34a_100000747503_200011215008 [0,2,0,0,0,0|0,0,2]=4 8291 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)F)F 7a_100000747503_200011215008 [0,2,0,0,0,0|0,0,2]=4 8292 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)Br 34a_100010068917_200011215008 [0,2,0,0,0,0|0,0,2]=4 8293 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)Br 7a_100010068917_200011215008 [0,2,0,0,0,0|0,0,2]=4 8294 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)Cl 34a_100010068924_200011215008 [0,2,0,0,0,0|0,0,2]=4 8295 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)Cl 7a_100010068924_200011215008 [0,2,0,0,0,0|0,0,2]=4 8296 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)F 34a_100000717995_200011215008 [0,2,0,0,0,0|0,0,2]=4 8297 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)I)F 7a_100000717995_200011215008 [0,2,0,0,0,0|0,0,2]=4 8298 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)N)C 34a_100011995906_200011215008 [0,2,0,0,0,0|0,0,2]=4 8299 B16R1.7629 CCCOC(=O)COc1cc(cc(c1)N)C 7a_100011995906_200011215008 [0,2,0,0,0,0|0,0,2]=4 8300 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000730704 [0,2,0,0,0,0|2,0,0]=4 8301 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)Br 1458a_200000688413_100011740638 [0,2,0,0,0,0|2,0,0]=4 8302 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000730704 [0,2,0,0,0,0|2,0,0]=4 8303 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)C 1458a_200000688413_100011713685 [0,2,0,0,0,0|2,0,0]=4 8304 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000730704 [0,2,0,0,0,0|2,0,0]=4 8305 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)Cl 1458a_200000688413_100011713710 [0,2,0,0,0,0|2,0,0]=4 8306 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000730704 [0,2,0,0,0,0|2,0,0]=4 8307 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)F 1458a_200000688413_100011217235 [0,2,0,0,0,0|2,0,0]=4 8308 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000730704 [0,2,0,0,0,0|2,0,0]=4 8309 B16R1.11227 C=C(C)CCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000730704 [0,2,0,0,0,0|2,0,0]=4 8310 B16R1.11227 C=C(C)CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000730704 [0,2,0,0,0,0|1,0,0]=3 8311 B16R1.11227 C=C(C)CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000730704 [0,2,0,0,0,0|1,0,0]=3 8312 B16R1.11227 C=C(C)CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000730704 [0,2,0,0,0,0|1,0,0]=3 8313 B16R1.11227 C=C(C)CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000730704 [0,2,0,0,0,0|1,0,0]=3 8314 B16R1.11227 C=C(C)CCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000730704 [0,2,0,0,0,0|1,1,0]=4 8315 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Br 11a_100000765925_100000184314 [0,2,0,0,0,0|2,0,0]=4 8316 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Br 1626a_100000765925_100000184314 [0,2,0,0,0,0|2,0,0]=4 8317 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Br 240690a_100000765925_100000184314 [0,2,0,0,0,0|2,0,0]=4 8318 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Br 527a_100000765925_100000184314 [0,2,0,0,0,0|2,0,0]=4 8319 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)C 11a_100000765925_100000234952 [0,2,0,0,0,0|2,0,0]=4 8320 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)C 1626a_100000765925_100000234952 [0,2,0,0,0,0|2,0,0]=4 8321 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)C 240690a_100000765925_100000234952 [0,2,0,0,0,0|2,0,0]=4 8322 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)C 527a_100000765925_100000234952 [0,2,0,0,0,0|2,0,0]=4 8323 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Cl 11a_100000765925_100000235675 [0,2,0,0,0,0|2,0,0]=4 8324 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Cl 1626a_100000765925_100000235675 [0,2,0,0,0,0|2,0,0]=4 8325 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Cl 240690a_100000765925_100000235675 [0,2,0,0,0,0|2,0,0]=4 8326 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)Cl 527a_100000765925_100000235675 [0,2,0,0,0,0|2,0,0]=4 8327 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)F 11a_100000765925_100000235673 [0,2,0,0,0,0|2,0,0]=4 8328 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)F 1626a_100000765925_100000235673 [0,2,0,0,0,0|2,0,0]=4 8329 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)F 240690a_100000765925_100000235673 [0,2,0,0,0,0|2,0,0]=4 8330 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)F 527a_100000765925_100000235673 [0,2,0,0,0,0|2,0,0]=4 8331 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)I 11a_100000765925_100010007846 [0,2,0,0,0,0|2,0,0]=4 8332 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)I 1626a_100000765925_100010007846 [0,2,0,0,0,0|2,0,0]=4 8333 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)I 240690a_100000765925_100010007846 [0,2,0,0,0,0|2,0,0]=4 8334 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)I 527a_100000765925_100010007846 [0,2,0,0,0,0|2,0,0]=4 8335 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)O 240690a_100000765925_100011216126 [0,2,0,0,0,0|2,0,0]=4 8336 B16R1.11227 C=C(C)CNC(=O)CCc1cccc(c1)O 527a_100000765925_100011216126 [0,2,0,0,0,0|2,0,0]=4 8337 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Br 11a_100000765925_100000182359 [0,2,0,0,0,0|1,0,0]=3 8338 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Br 1626a_100000765925_100000182359 [0,2,0,0,0,0|1,0,0]=3 8339 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Br 240690a_100000765925_100000182359 [0,2,0,0,0,0|1,0,0]=3 8340 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Br 527a_100000765925_100000182359 [0,2,0,0,0,0|1,0,0]=3 8341 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)C 11a_100000765925_100000183606 [0,2,0,0,0,0|1,0,0]=3 8342 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)C 1626a_100000765925_100000183606 [0,2,0,0,0,0|1,0,0]=3 8343 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)C 240690a_100000765925_100000183606 [0,2,0,0,0,0|1,0,0]=3 8344 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)C 527a_100000765925_100000183606 [0,2,0,0,0,0|1,0,0]=3 8345 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Cl 11a_100000765925_100000184978 [0,2,0,0,0,0|1,0,0]=3 8346 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Cl 1626a_100000765925_100000184978 [0,2,0,0,0,0|1,0,0]=3 8347 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Cl 240690a_100000765925_100000184978 [0,2,0,0,0,0|1,0,0]=3 8348 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)Cl 527a_100000765925_100000184978 [0,2,0,0,0,0|1,0,0]=3 8349 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)F 11a_100000765925_100000182781 [0,2,0,0,0,0|1,0,0]=3 8350 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)F 1626a_100000765925_100000182781 [0,2,0,0,0,0|1,0,0]=3 8351 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)F 240690a_100000765925_100000182781 [0,2,0,0,0,0|1,0,0]=3 8352 B16R1.11227 C=C(C)CNC(=O)COc1cccc(c1)F 527a_100000765925_100000182781 [0,2,0,0,0,0|1,0,0]=3 8353 B16R1.11227 C=C(C)CNC(=O)CSc1cccc(c1)Br 11a_100000765925_100000760868 [0,2,0,0,0,0|1,1,0]=4 8354 B16R1.11227 C=C(C)CNC(=O)CSc1cccc(c1)Br 1626a_100000765925_100000760868 [0,2,0,0,0,0|1,1,0]=4 8355 B16R1.11227 C=C(C)CNC(=O)CSc1cccc(c1)Br 240690a_100000765925_100000760868 [0,2,0,0,0,0|1,1,0]=4 8356 B16R1.11227 C=C(C)CNC(=O)CSc1cccc(c1)Br 527a_100000765925_100000760868 [0,2,0,0,0,0|1,1,0]=4 8357 B16R1.11227 C=C(C)COC(C)COc1cccc(c1)C 34a_200011219432_100000748629 [0,2,0,0,0,0|1,0,1]=4 8358 B16R1.11227 C=C(C)COC(C)COc1cccc(c1)C 7a_200011219432_100000748629 [0,2,0,0,0,0|1,0,1]=4 8359 B16R1.11227 C=C(F)COC(C)COc1cccc(c1)C 34a_200011219432_100009893438 [0,2,0,0,0,0|1,0,1]=4 8360 B16R1.11227 C=C(F)COC(C)COc1cccc(c1)C 7a_200011219432_100000042424 [0,2,0,0,0,0|1,0,1]=4 8361 B16R1.11227 Cc1cccc(c1)OCC(=O)NCC(=O)N 11a_100000711301_100000183606 [0,2,0,0,0,0|2,0,0]=4 8362 B16R1.11227 Cc1cccc(c1)OCC(=O)NCC(=O)N 240690a_100000711301_100000183606 [0,2,0,0,0,0|2,0,0]=4 8363 B16R1.11227 Cc1cccc(c1)OCC(=O)NCC(=O)N 527a_100000711301_100000183606 [0,2,0,0,0,0|2,0,0]=4 8364 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Br 11a_100000711301_100000182359 [0,2,0,0,0,0|2,0,0]=4 8365 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Br 240690a_100000711301_100000182359 [0,2,0,0,0,0|2,0,0]=4 8366 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Br 527a_100000711301_100000182359 [0,2,0,0,0,0|2,0,0]=4 8367 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Cl 11a_100000711301_100000184978 [0,2,0,0,0,0|2,0,0]=4 8368 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Cl 240690a_100000711301_100000184978 [0,2,0,0,0,0|2,0,0]=4 8369 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)Cl 527a_100000711301_100000184978 [0,2,0,0,0,0|2,0,0]=4 8370 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)F 11a_100000711301_100000182781 [0,2,0,0,0,0|2,0,0]=4 8371 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)F 240690a_100000711301_100000182781 [0,2,0,0,0,0|2,0,0]=4 8372 B16R1.11227 NC(=O)CNC(=O)COc1cccc(c1)F 527a_100000711301_100000182781 [0,2,0,0,0,0|2,0,0]=4 8373 B16R1.20755 C#Cc1cccc(c1)NCC(=O)NCC=C 2230a_100000735509_100000183597 [0,2,0,0,0,0|2,0,0]=4 8374 B16R1.20755 C#Cc1cccc(c1)NCC(=O)OCC=C 2230a_100000735509_100000033060 [0,2,0,0,0,0|1,0,0]=3 8375 B16R1.20755 C#Cc1cccc(c1)NCC(=O)OCC=C 34a_100000735509_100000033060 [0,2,0,0,0,0|1,0,0]=3 8376 B16R1.20755 C#Cc1cccc(c1)OCC(=O)NCC=C 7a_100011216014_100000183597 [0,2,0,0,0,0|1,0,0]=3 8377 B16R1.20755 C#Cc1cccc(c1)OCC(=O)OCC=C 34a_100011216014_100000033060 [0,2,0,0,0,0|0,0,0]=2 8378 B16R1.20755 C#Cc1cccc(c1)OCC(=O)OCC=C 7a_100011216014_100000033060 [0,2,0,0,0,0|0,0,0]=2 8379 B16R1.20755 C#Cc1cccc(c1)OCC(=O)OCCC 34a_100011216014_200011215008 [0,2,0,0,0,0|0,0,2]=4 8380 B16R1.20755 C#Cc1cccc(c1)OCC(=O)OCCC 7a_100011216014_200011215008 [0,2,0,0,0,0|0,0,2]=4 8381 B16R1.20755 C=CCCC(=O)CCc1cccc(c1)C#N 1458a_100011998624_100000754431 [0,2,0,0,0,0|2,0,0]=4 8382 B16R1.20755 C=CCCC(=O)CCc1cccc(c1)OC 1458a_100000234931_100000754431 [0,2,0,0,0,0|2,0,0]=4 8383 B16R1.20755 C=CCCC(=O)CCc1cccc(c1)OC 1458a_100000749702_100011713679 [0,2,0,0,0,0|2,0,0]=4 8384 B16R1.20755 C=CCCC(=O)COc1cccc(c1)C#N 1458a_100000230692_100000754431 [0,2,0,0,0,0|1,0,0]=3 8385 B16R1.20755 C=CCCC(=O)COc1cccc(c1)OC 1458a_100000182123_100000754431 [0,2,0,0,0,0|1,0,0]=3 8386 B16R1.20755 C=CCCC(=O)CSc1cccc(c1)OC 1458a_100000741315_100000754431 [0,2,0,0,0,0|1,1,0]=4 8387 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)C#N 1626a_100020586998_100011998624 [0,2,0,0,0,0|2,0,0]=4 8388 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)C#N 240690a_100020586998_100011998624 [0,2,0,0,0,0|2,0,0]=4 8389 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)C#N 527a_100020586998_100011998624 [0,2,0,0,0,0|2,0,0]=4 8390 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)OC 1626a_100020586998_100000234931 [0,2,0,0,0,0|2,0,0]=4 8391 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)OC 240690a_100020586998_100000234931 [0,2,0,0,0,0|2,0,0]=4 8392 B16R1.20755 C=CCNC(=O)CCc1cccc(c1)OC 527a_100020586998_100000234931 [0,2,0,0,0,0|2,0,0]=4 8393 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)C#N 7a_100000210922_100000183597 [0,2,0,0,0,0|2,0,0]=4 8394 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)CC 2230a_100000211250_100000183597 [0,2,0,0,0,0|2,0,0]=4 8395 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)CC 7a_100000211250_100000183597 [0,2,0,0,0,0|2,0,0]=4 8396 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)CF 2230a_100000126320_100000183597 [0,2,0,0,0,0|2,0,0]=4 8397 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)CF 7a_100000126320_100000183597 [0,2,0,0,0,0|2,0,0]=4 8398 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)CO 2230a_100000211919_100000183597 [0,2,0,0,0,0|2,0,0]=4 8399 B16R1.20755 C=CCNC(=O)CNc1cccc(c1)SC 2230a_100000210049_100000183597 [0,2,0,0,0,0|2,0,0]=4 8400 B16R1.20755 C=CCNC(=O)COc1ccc[n+](c1)CC 7a_100000731997_100000183597 [0,2,0,0,0,0|2,0,0]=4 8401 B16R1.20755 C=CCNC(=O)COc1cccc(c1)C#N 1626a_100020586998_100000230692 [0,2,0,0,0,0|1,0,0]=3 8402 B16R1.20755 C=CCNC(=O)COc1cccc(c1)C#N 240690a_100020586998_100000230692 [0,2,0,0,0,0|1,0,0]=3 8403 B16R1.20755 C=CCNC(=O)COc1cccc(c1)C#N 527a_100020586998_100000230692 [0,2,0,0,0,0|1,0,0]=3 8404 B16R1.20755 C=CCNC(=O)COc1cccc(c1)C#N 7a_100000184713_100000183597 [0,2,0,0,0,0|1,0,0]=3 8405 B16R1.20755 C=CCNC(=O)COc1cccc(c1)C=C 7a_100011309434_100000183597 [0,2,0,0,0,0|1,0,0]=3 8406 B16R1.20755 C=CCNC(=O)COc1cccc(c1)CBr 7a_100011660834_100000183597 [0,2,0,0,0,0|1,0,0]=3 8407 B16R1.20755 C=CCNC(=O)COc1cccc(c1)CC 7a_100000211550_100000183597 [0,2,0,0,0,0|1,0,0]=3 8408 B16R1.20755 C=CCNC(=O)COc1cccc(c1)CCl 7a_100000084143_100000183597 [0,2,0,0,0,0|1,0,0]=3 8409 B16R1.20755 C=CCNC(=O)COc1cccc(c1)CO 7a_100011214949_100000183597 [0,2,0,0,0,0|1,0,0]=3 8410 B16R1.20755 C=CCNC(=O)COc1cccc(c1)NC 7a_100000756613_100000183597 [0,2,0,0,0,0|1,0,0]=3 8411 B16R1.20755 C=CCNC(=O)COc1cccc(c1)OC 1626a_100020586998_100000182123 [0,2,0,0,0,0|1,0,0]=3 8412 B16R1.20755 C=CCNC(=O)COc1cccc(c1)OC 240690a_100020586998_100000182123 [0,2,0,0,0,0|1,0,0]=3 8413 B16R1.20755 C=CCNC(=O)COc1cccc(c1)OC 527a_100020586998_100000182123 [0,2,0,0,0,0|1,0,0]=3 8414 B16R1.20755 C=CCNC(=O)COc1cccc(c1)OC 7a_100000211255_100000183597 [0,2,0,0,0,0|1,0,0]=3 8415 B16R1.20755 C=CCNC(=O)COc1cccc(c1)SC 7a_100011265683_100000183597 [0,2,0,0,0,0|1,0,0]=3 8416 B16R1.20755 C=CCNC(=O)COc1ccnc(c1)C#N 7a_100011777083_100000183597 [0,2,0,0,0,0|2,0,0]=4 8417 B16R1.20755 C=CCNC(=O)COc1cncc(c1)C#N 7a_100012002025_100000183597 [0,2,0,0,0,0|2,0,0]=4 8418 B16R1.20755 C=CCNC(=O)COc1cncc(c1)CC 7a_200009861530_100000183597 [0,2,0,0,0,0|2,0,0]=4 8419 B16R1.20755 C=CCNC(=O)COc1cncc(c1)OC 7a_100000084572_100000183597 [0,2,0,0,0,0|2,0,0]=4 8420 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)C#N 62a_100000183597_100000189340 [0,2,0,0,0,0|1,1,0]=4 8421 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)C=C 62a_100000183597_100011215241 [0,2,0,0,0,0|1,1,0]=4 8422 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)C=C 62a_100011215241_100000183597 [0,2,0,0,0,0|1,1,0]=4 8423 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)C=O 62a_100000014684_100000183597 [0,2,0,0,0,0|1,1,0]=4 8424 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)C=O 62a_100000183597_100000014684 [0,2,0,0,0,0|1,1,0]=4 8425 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CC 62a_100000183597_100011263222 [0,2,0,0,0,0|1,1,0]=4 8426 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CC 62a_100011263222_100000183597 [0,2,0,0,0,0|1,1,0]=4 8427 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CF 62a_100000183597_100010878472 [0,2,0,0,0,0|1,1,0]=4 8428 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CF 62a_100010878472_100000183597 [0,2,0,0,0,0|1,1,0]=4 8429 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CN 62a_100000106179_100000183597 [0,2,0,0,0,0|1,1,0]=4 8430 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CN 62a_100000183597_100000106179 [0,2,0,0,0,0|1,1,0]=4 8431 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CO 62a_100000183597_100000687537 [0,2,0,0,0,0|1,1,0]=4 8432 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)CO 62a_100000687537_100000183597 [0,2,0,0,0,0|1,1,0]=4 8433 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)NC 62a_100000183597_100000219648 [0,2,0,0,0,0|1,1,0]=4 8434 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)NC 62a_100000219648_100000183597 [0,2,0,0,0,0|1,1,0]=4 8435 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)NN 62a_100000183597_100000217339 [0,2,0,0,0,0|1,1,0]=4 8436 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)NN 62a_100000217339_100000183597 [0,2,0,0,0,0|1,1,0]=4 8437 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)OC 1626a_100020586998_100000741315 [0,2,0,0,0,0|1,1,0]=4 8438 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)OC 240690a_100020586998_100000741315 [0,2,0,0,0,0|1,1,0]=4 8439 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)OC 527a_100020586998_100000741315 [0,2,0,0,0,0|1,1,0]=4 8440 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)OC 62a_100000183597_100000170001 [0,2,0,0,0,0|1,1,0]=4 8441 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)SC 62a_100000183597_100011215954 [0,2,0,0,0,0|1,1,0]=4 8442 B16R1.20755 C=CCNC(=O)CSc1cccc(c1)SC 62a_100011215954_100000183597 [0,2,0,0,0,0|1,1,0]=4 8443 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)C#N 34a_100000210922_100000033060 [0,2,0,0,0,0|1,0,0]=3 8444 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)C#N 7a_100000210922_100000033060 [0,2,0,0,0,0|1,0,0]=3 8445 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)C=C 34a_100011827668_100000033060 [0,2,0,0,0,0|1,0,0]=3 8446 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CC 2230a_100000211250_100000033060 [0,2,0,0,0,0|1,0,0]=3 8447 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CC 34a_100000211250_100000033060 [0,2,0,0,0,0|1,0,0]=3 8448 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CC 7a_100000211250_100000033060 [0,2,0,0,0,0|1,0,0]=3 8449 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CF 2230a_100000126320_100000033060 [0,2,0,0,0,0|1,0,0]=3 8450 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CF 34a_100000126320_100000033060 [0,2,0,0,0,0|1,0,0]=3 8451 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CF 7a_100000126320_100000033060 [0,2,0,0,0,0|1,0,0]=3 8452 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CO 2230a_100000211919_100000033060 [0,2,0,0,0,0|1,0,0]=3 8453 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)CO 34a_100000211919_100000033060 [0,2,0,0,0,0|1,0,0]=3 8454 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)OC 34a_100000210024_100000033060 [0,2,0,0,0,0|1,0,0]=3 8455 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)SC 2230a_100000210049_100000033060 [0,2,0,0,0,0|1,0,0]=3 8456 B16R1.20755 C=CCOC(=O)CNc1cccc(c1)SC 34a_100000210049_100000033060 [0,2,0,0,0,0|1,0,0]=3 8457 B16R1.20755 C=CCOC(=O)COc1cc(ccn1)CN 34a_100000748557_100000033060 [0,2,0,0,0,0|1,0,0]=3 8458 B16R1.20755 C=CCOC(=O)COc1ccc[n+](c1)CC 34a_100000731997_100000033060 [0,2,0,0,0,0|1,0,0]=3 8459 B16R1.20755 C=CCOC(=O)COc1ccc[n+](c1)CC 7a_100000731997_100000033060 [0,2,0,0,0,0|1,0,0]=3 8460 B16R1.20755 C=CCOC(=O)COc1cccc(c1)C#N 34a_100000184713_100000033060 [0,2,0,0,0,0|0,0,0]=2 8461 B16R1.20755 C=CCOC(=O)COc1cccc(c1)C#N 7a_100000184713_100000033060 [0,2,0,0,0,0|0,0,0]=2 8462 B16R1.20755 C=CCOC(=O)COc1cccc(c1)C=C 34a_100011309434_100000033060 [0,2,0,0,0,0|0,0,0]=2 8463 B16R1.20755 C=CCOC(=O)COc1cccc(c1)C=C 7a_100011309434_100000033060 [0,2,0,0,0,0|0,0,0]=2 8464 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CBr 34a_100011660834_100000033060 [0,2,0,0,0,0|0,0,0]=2 8465 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CBr 7a_100011660834_100000033060 [0,2,0,0,0,0|0,0,0]=2 8466 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CC 34a_100000211550_100000033060 [0,2,0,0,0,0|0,0,0]=2 8467 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CC 7a_100000211550_100000033060 [0,2,0,0,0,0|0,0,0]=2 8468 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CCl 34a_100000084143_100000033060 [0,2,0,0,0,0|0,0,0]=2 8469 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CCl 7a_100000084143_100000033060 [0,2,0,0,0,0|0,0,0]=2 8470 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CN 34a_100000743036_100000033060 [0,2,0,0,0,0|0,0,0]=2 8471 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CO 34a_100011214949_100000033060 [0,2,0,0,0,0|0,0,0]=2 8472 B16R1.20755 C=CCOC(=O)COc1cccc(c1)CO 7a_100011214949_100000033060 [0,2,0,0,0,0|0,0,0]=2 8473 B16R1.20755 C=CCOC(=O)COc1cccc(c1)NC 34a_100000756613_100000033060 [0,2,0,0,0,0|0,0,0]=2 8474 B16R1.20755 C=CCOC(=O)COc1cccc(c1)NC 7a_100000756613_100000033060 [0,2,0,0,0,0|0,0,0]=2 8475 B16R1.20755 C=CCOC(=O)COc1cccc(c1)OC 34a_100000211255_100000033060 [0,2,0,0,0,0|0,0,0]=2 8476 B16R1.20755 C=CCOC(=O)COc1cccc(c1)OC 7a_100000211255_100000033060 [0,2,0,0,0,0|0,0,0]=2 8477 B16R1.20755 C=CCOC(=O)COc1cccc(c1)SC 34a_100011265683_100000033060 [0,2,0,0,0,0|0,0,0]=2 8478 B16R1.20755 C=CCOC(=O)COc1cccc(c1)SC 7a_100011265683_100000033060 [0,2,0,0,0,0|0,0,0]=2 8479 B16R1.20755 C=CCOC(=O)COc1ccnc(c1)C#N 34a_100011777083_100000033060 [0,2,0,0,0,0|1,0,0]=3 8480 B16R1.20755 C=CCOC(=O)COc1ccnc(c1)C#N 7a_100011777083_100000033060 [0,2,0,0,0,0|1,0,0]=3 8481 B16R1.20755 C=CCOC(=O)COc1ccnc(c1)OC 34a_100012181050_100000033060 [0,2,0,0,0,0|1,0,0]=3 8482 B16R1.20755 C=CCOC(=O)COc1cncc(c1)C#N 34a_100012002025_100000033060 [0,2,0,0,0,0|1,0,0]=3 8483 B16R1.20755 C=CCOC(=O)COc1cncc(c1)C#N 7a_100012002025_100000033060 [0,2,0,0,0,0|1,0,0]=3 8484 B16R1.20755 C=CCOC(=O)COc1cncc(c1)CC 34a_200009861530_100000033060 [0,2,0,0,0,0|1,0,0]=3 8485 B16R1.20755 C=CCOC(=O)COc1cncc(c1)CC 7a_200009861530_100000033060 [0,2,0,0,0,0|1,0,0]=3 8486 B16R1.20755 C=CCOC(=O)COc1cncc(c1)OC 34a_100000084572_100000033060 [0,2,0,0,0,0|1,0,0]=3 8487 B16R1.20755 C=CCOC(=O)COc1cncc(c1)OC 7a_100000084572_100000033060 [0,2,0,0,0,0|1,0,0]=3 8488 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)C#N 62a_100000033060_100011291639 [0,2,0,0,0,0|1,1,0]=4 8489 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)C=O 62a_100000033060_100011290808 [0,2,0,0,0,0|1,1,0]=4 8490 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)C=O 62a_100011290808_100000033060 [0,2,0,0,0,0|1,1,0]=4 8491 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CC 62a_100000033060_100009817561 [0,2,0,0,0,0|1,1,0]=4 8492 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CC 62a_100009817561_100000033060 [0,2,0,0,0,0|1,1,0]=4 8493 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CN 62a_100000033060_100025757509 [0,2,0,0,0,0|1,1,0]=4 8494 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CN 62a_100025757509_100000033060 [0,2,0,0,0,0|1,1,0]=4 8495 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CO 62a_100000033060_100009814636 [0,2,0,0,0,0|1,1,0]=4 8496 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)CO 62a_100009814636_100000033060 [0,2,0,0,0,0|1,1,0]=4 8497 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)NC 62a_100000033060_100009869472 [0,2,0,0,0,0|1,1,0]=4 8498 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)NC 62a_100009869472_100000033060 [0,2,0,0,0,0|1,1,0]=4 8499 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)NN 62a_100000033060_100000089018 [0,2,0,0,0,0|1,1,0]=4 8500 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)NN 62a_100000089018_100000033060 [0,2,0,0,0,0|1,1,0]=4 8501 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)OC 62a_100000033060_100011216251 [0,2,0,0,0,0|1,1,0]=4 8502 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)OC 62a_100009817693_100000033060 [0,2,0,0,0,0|1,1,0]=4 8503 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)SC 62a_100000033060_100010883326 [0,2,0,0,0,0|1,1,0]=4 8504 B16R1.20755 C=CCOC(=O)CSc1cc(ccn1)SC 62a_100010883326_100000033060 [0,2,0,0,0,0|1,1,0]=4 8505 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)C#N 62a_100000033060_100000189340 [0,2,0,0,0,0|0,1,0]=3 8506 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)C=C 62a_100000033060_100011215241 [0,2,0,0,0,0|0,1,0]=3 8507 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)C=C 62a_100011215241_100000033060 [0,2,0,0,0,0|0,1,0]=3 8508 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)C=O 62a_100000014684_100000033060 [0,2,0,0,0,0|0,1,0]=3 8509 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)C=O 62a_100000033060_100000014684 [0,2,0,0,0,0|0,1,0]=3 8510 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CC 62a_100000033060_100011263222 [0,2,0,0,0,0|0,1,0]=3 8511 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CC 62a_100011263222_100000033060 [0,2,0,0,0,0|0,1,0]=3 8512 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CF 62a_100000033060_100010878472 [0,2,0,0,0,0|0,1,0]=3 8513 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CF 62a_100010878472_100000033060 [0,2,0,0,0,0|0,1,0]=3 8514 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CN 62a_100000033060_100000106179 [0,2,0,0,0,0|0,1,0]=3 8515 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CN 62a_100000106179_100000033060 [0,2,0,0,0,0|0,1,0]=3 8516 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CO 62a_100000033060_100000687537 [0,2,0,0,0,0|0,1,0]=3 8517 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)CO 62a_100000687537_100000033060 [0,2,0,0,0,0|0,1,0]=3 8518 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)NC 62a_100000033060_100000219648 [0,2,0,0,0,0|0,1,0]=3 8519 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)NC 62a_100000219648_100000033060 [0,2,0,0,0,0|0,1,0]=3 8520 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)NN 62a_100000033060_100000217339 [0,2,0,0,0,0|0,1,0]=3 8521 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)NN 62a_100000217339_100000033060 [0,2,0,0,0,0|0,1,0]=3 8522 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)OC 62a_100000033060_100000170001 [0,2,0,0,0,0|0,1,0]=3 8523 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)SC 62a_100000033060_100011215954 [0,2,0,0,0,0|0,1,0]=3 8524 B16R1.20755 C=CCOC(=O)CSc1cccc(c1)SC 62a_100011215954_100000033060 [0,2,0,0,0,0|0,1,0]=3 8525 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)C#N 62a_100000033060_100011934037 [0,2,0,0,0,0|1,1,0]=4 8526 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)C=O 62a_100000033060_100000688028 [0,2,0,0,0,0|1,1,0]=4 8527 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)C=O 62a_100000688028_100000033060 [0,2,0,0,0,0|1,1,0]=4 8528 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CC 62a_100000033060_100009856026 [0,2,0,0,0,0|1,1,0]=4 8529 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CC 62a_100009856026_100000033060 [0,2,0,0,0,0|1,1,0]=4 8530 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CN 62a_100000033060_100016990191 [0,2,0,0,0,0|1,1,0]=4 8531 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CN 62a_100016990191_100000033060 [0,2,0,0,0,0|1,1,0]=4 8532 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CO 62a_100000033060_100000694195 [0,2,0,0,0,0|1,1,0]=4 8533 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)CO 62a_100000694195_100000033060 [0,2,0,0,0,0|1,1,0]=4 8534 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)NC 62a_100000033060_100000703281 [0,2,0,0,0,0|1,1,0]=4 8535 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)NC 62a_100000703281_100000033060 [0,2,0,0,0,0|1,1,0]=4 8536 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)NN 62a_100000033060_100009817029 [0,2,0,0,0,0|1,1,0]=4 8537 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)NN 62a_100009817029_100000033060 [0,2,0,0,0,0|1,1,0]=4 8538 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)OC 62a_100000033060_100000760917 [0,2,0,0,0,0|1,1,0]=4 8539 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)OC 62a_100000760917_100000033060 [0,2,0,0,0,0|1,1,0]=4 8540 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)SC 62a_100000033060_100011960944 [0,2,0,0,0,0|1,1,0]=4 8541 B16R1.20755 C=CCOC(=O)CSc1cccc(n1)SC 62a_100011960944_100000033060 [0,2,0,0,0,0|1,1,0]=4 8542 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)C#N 62a_100000033060_100000685610 [0,2,0,0,0,0|1,1,0]=4 8543 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)C=C 62a_100000033060_100009845566 [0,2,0,0,0,0|1,1,0]=4 8544 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)C=C 62a_100009845566_100000033060 [0,2,0,0,0,0|1,1,0]=4 8545 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)C=O 62a_100000033060_100011998288 [0,2,0,0,0,0|1,1,0]=4 8546 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)C=O 62a_100011998288_100000033060 [0,2,0,0,0,0|1,1,0]=4 8547 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CC 62a_100000033060_100009820011 [0,2,0,0,0,0|1,1,0]=4 8548 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CC 62a_100009820011_100000033060 [0,2,0,0,0,0|1,1,0]=4 8549 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CN 62a_100000033060_100000085674 [0,2,0,0,0,0|1,1,0]=4 8550 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CN 62a_100000085674_100000033060 [0,2,0,0,0,0|1,1,0]=4 8551 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CO 62a_100000033060_100000748867 [0,2,0,0,0,0|1,1,0]=4 8552 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)CO 62a_100000748867_100000033060 [0,2,0,0,0,0|1,1,0]=4 8553 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)NC 62a_100000033060_100009819592 [0,2,0,0,0,0|1,1,0]=4 8554 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)NC 62a_100009819592_100000033060 [0,2,0,0,0,0|1,1,0]=4 8555 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)NN 62a_100000033060_100000764631 [0,2,0,0,0,0|1,1,0]=4 8556 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)NN 62a_100000764631_100000033060 [0,2,0,0,0,0|1,1,0]=4 8557 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)OC 62a_100000033060_100000117307 [0,2,0,0,0,0|1,1,0]=4 8558 B16R1.20755 C=CCOC(=O)CSc1ccnc(c1)OC 62a_100000117307_100000033060 [0,2,0,0,0,0|1,1,0]=4 8559 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)C#N 62a_100000033060_100000686085 [0,2,0,0,0,0|1,1,0]=4 8560 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)C=C 62a_100000033060_200012180632 [0,2,0,0,0,0|1,1,0]=4 8561 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)C=C 62a_200012180632_100000033060 [0,2,0,0,0,0|1,1,0]=4 8562 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)C=O 62a_100000033060_100000687066 [0,2,0,0,0,0|1,1,0]=4 8563 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)C=O 62a_100000687066_100000033060 [0,2,0,0,0,0|1,1,0]=4 8564 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CC 62a_100000033060_200009819073 [0,2,0,0,0,0|1,1,0]=4 8565 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CC 62a_200009819073_100000033060 [0,2,0,0,0,0|1,1,0]=4 8566 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CN 62a_100000033060_100011249555 [0,2,0,0,0,0|1,1,0]=4 8567 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CN 62a_100011249555_100000033060 [0,2,0,0,0,0|1,1,0]=4 8568 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CO 62a_100000033060_100011259137 [0,2,0,0,0,0|1,1,0]=4 8569 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)CO 62a_100011259137_100000033060 [0,2,0,0,0,0|1,1,0]=4 8570 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)NC 62a_100000033060_100012184536 [0,2,0,0,0,0|1,1,0]=4 8571 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)NC 62a_100012184536_100000033060 [0,2,0,0,0,0|1,1,0]=4 8572 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)NN 62a_100000033060_100000727789 [0,2,0,0,0,0|1,1,0]=4 8573 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)NN 62a_100000727789_100000033060 [0,2,0,0,0,0|1,1,0]=4 8574 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)OC 62a_100000033060_100000050176 [0,2,0,0,0,0|1,1,0]=4 8575 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)OC 62a_100000050176_100000033060 [0,2,0,0,0,0|1,1,0]=4 8576 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)SC 62a_100000033060_100009816972 [0,2,0,0,0,0|1,1,0]=4 8577 B16R1.20755 C=CCOC(=O)CSc1cncc(c1)SC 62a_100009816972_100000033060 [0,2,0,0,0,0|1,1,0]=4 8578 B16R1.20755 C=CCOC(C)COc1cccc(c1)OC 34a_100011216697_100015514636 [0,2,0,0,0,0|1,0,1]=4 8579 B16R1.20755 C=CCOC(C)COc1cccc(c1)OC 7a_100011216697_100015514636 [0,2,0,0,0,0|1,0,1]=4 8580 B16R1.20755 C=Cc1cccc(c1)OCC(=O)OCCC 34a_100011309434_200011215008 [0,2,0,0,0,0|0,0,2]=4 8581 B16R1.20755 C=Cc1cccc(c1)OCC(=O)OCCC 7a_100011309434_200011215008 [0,2,0,0,0,0|0,0,2]=4 8582 B16R1.20755 CCCOC(=O)COc1cccc(c1)C#N 34a_100000184713_200011215008 [0,2,0,0,0,0|0,0,2]=4 8583 B16R1.20755 CCCOC(=O)COc1cccc(c1)C#N 7a_100000184713_200011215008 [0,2,0,0,0,0|0,0,2]=4 8584 B16R1.20755 CCCOC(=O)COc1cccc(c1)CBr 34a_100011660834_200011215008 [0,2,0,0,0,0|0,0,2]=4 8585 B16R1.20755 CCCOC(=O)COc1cccc(c1)CBr 7a_100011660834_200011215008 [0,2,0,0,0,0|0,0,2]=4 8586 B16R1.20755 CCCOC(=O)COc1cccc(c1)CC 34a_100000211550_200011215008 [0,2,0,0,0,0|0,0,2]=4 8587 B16R1.20755 CCCOC(=O)COc1cccc(c1)CC 7a_100000211550_200011215008 [0,2,0,0,0,0|0,0,2]=4 8588 B16R1.20755 CCCOC(=O)COc1cccc(c1)CCl 34a_100000084143_200011215008 [0,2,0,0,0,0|0,0,2]=4 8589 B16R1.20755 CCCOC(=O)COc1cccc(c1)CCl 7a_100000084143_200011215008 [0,2,0,0,0,0|0,0,2]=4 8590 B16R1.20755 CCCOC(=O)COc1cccc(c1)CN 34a_100000743036_200011215008 [0,2,0,0,0,0|0,0,2]=4 8591 B16R1.20755 CCCOC(=O)COc1cccc(c1)CO 34a_100011214949_200011215008 [0,2,0,0,0,0|0,0,2]=4 8592 B16R1.20755 CCCOC(=O)COc1cccc(c1)CO 7a_100011214949_200011215008 [0,2,0,0,0,0|0,0,2]=4 8593 B16R1.20755 CCCOC(=O)COc1cccc(c1)NC 34a_100000756613_200011215008 [0,2,0,0,0,0|0,0,2]=4 8594 B16R1.20755 CCCOC(=O)COc1cccc(c1)NC 7a_100000756613_200011215008 [0,2,0,0,0,0|0,0,2]=4 8595 B16R1.20755 CCCOC(=O)COc1cccc(c1)OC 34a_100000211255_200011215008 [0,2,0,0,0,0|0,0,2]=4 8596 B16R1.20755 CCCOC(=O)COc1cccc(c1)OC 7a_100000211255_200011215008 [0,2,0,0,0,0|0,0,2]=4 8597 B16R1.20755 CCCOC(=O)COc1cccc(c1)SC 34a_100011265683_200011215008 [0,2,0,0,0,0|0,0,2]=4 8598 B16R1.20755 CCCOC(=O)COc1cccc(c1)SC 7a_100011265683_200011215008 [0,2,0,0,0,0|0,0,2]=4 8599 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_100000754431 [0,2,0,0,0,0|2,0,0]=4 8600 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_100000754431 [0,2,0,0,0,0|2,0,0]=4 8601 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_100000754431 [0,2,0,0,0,0|2,0,0]=4 8602 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_100000754431 [0,2,0,0,0,0|2,0,0]=4 8603 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_100000754431 [0,2,0,0,0,0|2,0,0]=4 8604 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_100000754431 [0,2,0,0,0,0|2,0,0]=4 8605 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000749702_100011713676 [0,2,0,0,0,0|2,0,0]=4 8606 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000749702_100012361305 [0,2,0,0,0,0|2,0,0]=4 8607 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_100000754431 [0,2,0,0,0,0|2,0,0]=4 8608 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_100000754431 [0,2,0,0,0,0|2,0,0]=4 8609 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_100000754431 [0,2,0,0,0,0|2,0,0]=4 8610 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_100000754431 [0,2,0,0,0,0|2,0,0]=4 8611 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_100000754431 [0,2,0,0,0,0|2,0,0]=4 8612 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)F)F 1458a_100000749702_100000690553 [0,2,0,0,0,0|2,0,0]=4 8613 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000754431 [0,2,0,0,0,0|2,0,0]=4 8614 B16R1.20760 C=CCCC(=O)CCc1ccc(c(c1)O)O 1458a_100000749702_200010393615 [0,2,0,0,0,0|2,0,0]=4 8615 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_100000754431 [0,2,0,0,0,0|1,0,0]=3 8616 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_100000754431 [0,2,0,0,0,0|1,0,0]=3 8617 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_100000754431 [0,2,0,0,0,0|1,0,0]=3 8618 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_100000754431 [0,2,0,0,0,0|1,0,0]=3 8619 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_100000754431 [0,2,0,0,0,0|1,0,0]=3 8620 B16R1.20760 C=CCCC(=O)COc1ccc(c(c1)F)F 1458a_100000246063_100000754431 [0,2,0,0,0,0|1,0,0]=3 8621 B16R1.20760 C=CCCC(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_100000754431 [0,2,0,0,0,0|1,1,0]=4 8622 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)C 1626a_100020586998_100010220830 [0,2,0,0,0,0|2,0,0]=4 8623 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)C 240690a_100020586998_100010220830 [0,2,0,0,0,0|2,0,0]=4 8624 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)C 527a_100020586998_100010220830 [0,2,0,0,0,0|2,0,0]=4 8625 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)F 1626a_100020586998_100011308364 [0,2,0,0,0,0|2,0,0]=4 8626 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)F 240690a_100020586998_100011308364 [0,2,0,0,0,0|2,0,0]=4 8627 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Br)F 527a_100020586998_100011308364 [0,2,0,0,0,0|2,0,0]=4 8628 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)C 1626a_100020586998_100011338283 [0,2,0,0,0,0|2,0,0]=4 8629 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)C 240690a_100020586998_100011338283 [0,2,0,0,0,0|2,0,0]=4 8630 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)C 527a_100020586998_100011338283 [0,2,0,0,0,0|2,0,0]=4 8631 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)F 1626a_100020586998_100011615030 [0,2,0,0,0,0|2,0,0]=4 8632 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)F 240690a_100020586998_100011615030 [0,2,0,0,0,0|2,0,0]=4 8633 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)C)F 527a_100020586998_100011615030 [0,2,0,0,0,0|2,0,0]=4 8634 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Br 1626a_100020586998_100009812081 [0,2,0,0,0,0|2,0,0]=4 8635 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Br 240690a_100020586998_100009812081 [0,2,0,0,0,0|2,0,0]=4 8636 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Br 527a_100020586998_100009812081 [0,2,0,0,0,0|2,0,0]=4 8637 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Cl 1626a_100020586998_100000735579 [0,2,0,0,0,0|2,0,0]=4 8638 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Cl 240690a_100020586998_100000735579 [0,2,0,0,0,0|2,0,0]=4 8639 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)Cl 527a_100020586998_100000735579 [0,2,0,0,0,0|2,0,0]=4 8640 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)F 1626a_100020586998_100011218152 [0,2,0,0,0,0|2,0,0]=4 8641 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)F 240690a_100020586998_100011218152 [0,2,0,0,0,0|2,0,0]=4 8642 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)Cl)F 527a_100020586998_100011218152 [0,2,0,0,0,0|2,0,0]=4 8643 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Br 1626a_100020586998_100010146367 [0,2,0,0,0,0|2,0,0]=4 8644 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Br 240690a_100020586998_100010146367 [0,2,0,0,0,0|2,0,0]=4 8645 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Br 527a_100020586998_100010146367 [0,2,0,0,0,0|2,0,0]=4 8646 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)C 1626a_100020586998_100011830284 [0,2,0,0,0,0|2,0,0]=4 8647 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)C 240690a_100020586998_100011830284 [0,2,0,0,0,0|2,0,0]=4 8648 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)C 527a_100020586998_100011830284 [0,2,0,0,0,0|2,0,0]=4 8649 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Cl 1626a_100020586998_100011518922 [0,2,0,0,0,0|2,0,0]=4 8650 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Cl 240690a_100020586998_100011518922 [0,2,0,0,0,0|2,0,0]=4 8651 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)Cl 527a_100020586998_100011518922 [0,2,0,0,0,0|2,0,0]=4 8652 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)F 1626a_100020586998_100000737970 [0,2,0,0,0,0|2,0,0]=4 8653 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)F 240690a_100020586998_100000737970 [0,2,0,0,0,0|2,0,0]=4 8654 B16R1.20760 C=CCNC(=O)CCc1ccc(c(c1)F)F 527a_100020586998_100000737970 [0,2,0,0,0,0|2,0,0]=4 8655 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)Br 2230a_100011306057_100000183597 [0,2,0,0,0,0|2,0,0]=4 8656 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)Br 7a_100011306057_100000183597 [0,2,0,0,0,0|2,0,0]=4 8657 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)C 2230a_100000736455_100000183597 [0,2,0,0,0,0|2,0,0]=4 8658 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)C 7a_100000736455_100000183597 [0,2,0,0,0,0|2,0,0]=4 8659 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000183597 [0,2,0,0,0,0|2,0,0]=4 8660 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)F 2230a_100000760356_100000183597 [0,2,0,0,0,0|2,0,0]=4 8661 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Br)F 7a_100000760356_100000183597 [0,2,0,0,0,0|2,0,0]=4 8662 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000183597 [0,2,0,0,0,0|2,0,0]=4 8663 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)Br 7a_100000210723_100000183597 [0,2,0,0,0,0|2,0,0]=4 8664 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)C 2230a_100000724040_100000183597 [0,2,0,0,0,0|2,0,0]=4 8665 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)C 7a_100000724040_100000183597 [0,2,0,0,0,0|2,0,0]=4 8666 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000183597 [0,2,0,0,0,0|2,0,0]=4 8667 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000183597 [0,2,0,0,0,0|2,0,0]=4 8668 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)F 2230a_100000750164_100000183597 [0,2,0,0,0,0|2,0,0]=4 8669 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)F 7a_100000750164_100000183597 [0,2,0,0,0,0|2,0,0]=4 8670 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)I 7a_100000198070_100000183597 [0,2,0,0,0,0|2,0,0]=4 8671 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000183597 [0,2,0,0,0,0|2,0,0]=4 8672 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000183597 [0,2,0,0,0,0|2,0,0]=4 8673 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)Br 7a_100000687081_100000183597 [0,2,0,0,0,0|2,0,0]=4 8674 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)C 2230a_100000188892_100000183597 [0,2,0,0,0,0|2,0,0]=4 8675 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)C 7a_100000188892_100000183597 [0,2,0,0,0,0|2,0,0]=4 8676 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000183597 [0,2,0,0,0,0|2,0,0]=4 8677 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)F 2230a_100000211060_100000183597 [0,2,0,0,0,0|2,0,0]=4 8678 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)Cl)F 7a_100000211060_100000183597 [0,2,0,0,0,0|2,0,0]=4 8679 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)Br 2230a_100000759894_100000183597 [0,2,0,0,0,0|2,0,0]=4 8680 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)Br 7a_100000759894_100000183597 [0,2,0,0,0,0|2,0,0]=4 8681 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)C 2230a_100000210958_100000183597 [0,2,0,0,0,0|2,0,0]=4 8682 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)C 7a_100000210958_100000183597 [0,2,0,0,0,0|2,0,0]=4 8683 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)Cl 2230a_100000739366_100000183597 [0,2,0,0,0,0|2,0,0]=4 8684 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)Cl 7a_100000739366_100000183597 [0,2,0,0,0,0|2,0,0]=4 8685 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)F 2230a_100000210724_100000183597 [0,2,0,0,0,0|2,0,0]=4 8686 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)F 7a_100000210724_100000183597 [0,2,0,0,0,0|2,0,0]=4 8687 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)I 7a_100011356925_100000183597 [0,2,0,0,0,0|2,0,0]=4 8688 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000183597 [0,2,0,0,0,0|2,0,0]=4 8689 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)I)C 7a_100000184131_100000183597 [0,2,0,0,0,0|2,0,0]=4 8690 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)I)F 7a_114828291077_100000183597 [0,2,0,0,0,0|2,0,0]=4 8691 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000183597 [0,2,0,0,0,0|2,0,0]=4 8692 B16R1.20760 C=CCNC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000183597 [0,2,0,0,0,0|2,0,0]=4 8693 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Br)C 7a_100011380479_100000183597 [0,2,0,0,0,0|1,0,0]=3 8694 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000183597 [0,2,0,0,0,0|1,0,0]=3 8695 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Br)F 7a_100000693481_100000183597 [0,2,0,0,0,0|1,0,0]=3 8696 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Br)I 7a_100000701344_100000183597 [0,2,0,0,0,0|1,0,0]=3 8697 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Br)N 7a_100012001276_100000183597 [0,2,0,0,0,0|1,0,0]=3 8698 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_100000183597 [0,2,0,0,0,0|1,0,0]=3 8699 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)C 1626a_100020586998_100000182425 [0,2,0,0,0,0|1,0,0]=3 8700 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)C 240690a_100020586998_100000182425 [0,2,0,0,0,0|1,0,0]=3 8701 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)C 527a_100020586998_100000182425 [0,2,0,0,0,0|1,0,0]=3 8702 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)C 7a_100000210932_100000183597 [0,2,0,0,0,0|1,0,0]=3 8703 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)Cl 1626a_100020586998_100000182483 [0,2,0,0,0,0|1,0,0]=3 8704 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)Cl 240690a_100020586998_100000182483 [0,2,0,0,0,0|1,0,0]=3 8705 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)Cl 527a_100020586998_100000182483 [0,2,0,0,0,0|1,0,0]=3 8706 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_100000183597 [0,2,0,0,0,0|1,0,0]=3 8707 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)F 7a_100000751312_100000183597 [0,2,0,0,0,0|1,0,0]=3 8708 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)I 7a_100000729255_100000183597 [0,2,0,0,0,0|1,0,0]=3 8709 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)C)N 7a_100000756630_100000183597 [0,2,0,0,0,0|1,0,0]=3 8710 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000183597 [0,2,0,0,0,0|1,0,0]=3 8711 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)C 7a_100011265682_100000183597 [0,2,0,0,0,0|1,0,0]=3 8712 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)Cl 1626a_100020586998_100000191221 [0,2,0,0,0,0|1,0,0]=3 8713 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)Cl 240690a_100020586998_100000191221 [0,2,0,0,0,0|1,0,0]=3 8714 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)Cl 527a_100020586998_100000191221 [0,2,0,0,0,0|1,0,0]=3 8715 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000183597 [0,2,0,0,0,0|1,0,0]=3 8716 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)F 1626a_100020586998_100000191248 [0,2,0,0,0,0|1,0,0]=3 8717 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)F 240690a_100020586998_100000191248 [0,2,0,0,0,0|1,0,0]=3 8718 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)F 527a_100020586998_100000191248 [0,2,0,0,0,0|1,0,0]=3 8719 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)F 7a_100000211030_100000183597 [0,2,0,0,0,0|1,0,0]=3 8720 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)I 7a_100000047559_100000183597 [0,2,0,0,0,0|1,0,0]=3 8721 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)Cl)N 7a_100011215599_100000183597 [0,2,0,0,0,0|1,0,0]=3 8722 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)Br 7a_100000755031_100000183597 [0,2,0,0,0,0|1,0,0]=3 8723 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)C 7a_100000722560_100000183597 [0,2,0,0,0,0|1,0,0]=3 8724 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)Cl 1626a_100020586998_100012982646 [0,2,0,0,0,0|1,0,0]=3 8725 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)Cl 240690a_100020586998_100012982646 [0,2,0,0,0,0|1,0,0]=3 8726 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)Cl 527a_100020586998_100012982646 [0,2,0,0,0,0|1,0,0]=3 8727 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)Cl 7a_100000691581_100000183597 [0,2,0,0,0,0|1,0,0]=3 8728 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)F 1626a_100020586998_100000246063 [0,2,0,0,0,0|1,0,0]=3 8729 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)F 240690a_100020586998_100000246063 [0,2,0,0,0,0|1,0,0]=3 8730 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)F 527a_100020586998_100000246063 [0,2,0,0,0,0|1,0,0]=3 8731 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)F 7a_100000181275_100000183597 [0,2,0,0,0,0|1,0,0]=3 8732 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)I 7a_100009990212_100000183597 [0,2,0,0,0,0|1,0,0]=3 8733 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)F)N 7a_100000759473_100000183597 [0,2,0,0,0,0|1,0,0]=3 8734 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)I)Br 7a_100012339312_100000183597 [0,2,0,0,0,0|1,0,0]=3 8735 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)I)Cl 7a_100000049588_100000183597 [0,2,0,0,0,0|1,0,0]=3 8736 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)I)N 7a_100010084370_100000183597 [0,2,0,0,0,0|1,0,0]=3 8737 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)N)Br 7a_100011999798_100000183597 [0,2,0,0,0,0|1,0,0]=3 8738 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)N)C 7a_100011216113_100000183597 [0,2,0,0,0,0|1,0,0]=3 8739 B16R1.20760 C=CCNC(=O)COc1ccc(c(c1)N)F 7a_100012017239_100000183597 [0,2,0,0,0,0|1,0,0]=3 8740 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Br)C 7a_100009819603_100000183597 [0,2,0,0,0,0|2,0,0]=4 8741 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Br)Cl 7a_100012356455_100000183597 [0,2,0,0,0,0|2,0,0]=4 8742 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Br)F 7a_100009817267_100000183597 [0,2,0,0,0,0|2,0,0]=4 8743 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)C)Br 7a_100012000486_100000183597 [0,2,0,0,0,0|2,0,0]=4 8744 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)C)C 7a_100009854398_100000183597 [0,2,0,0,0,0|2,0,0]=4 8745 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)C)Cl 7a_100012002680_100000183597 [0,2,0,0,0,0|2,0,0]=4 8746 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)C)F 7a_100000094615_100000183597 [0,2,0,0,0,0|2,0,0]=4 8747 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Cl)Br 7a_100010209684_100000183597 [0,2,0,0,0,0|2,0,0]=4 8748 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Cl)Cl 7a_100000094354_100000183597 [0,2,0,0,0,0|2,0,0]=4 8749 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)Cl)F 7a_100000087088_100000183597 [0,2,0,0,0,0|2,0,0]=4 8750 B16R1.20760 C=CCNC(=O)COc1cnc(c(c1)F)Cl 7a_100000063512_100000183597 [0,2,0,0,0,0|2,0,0]=4 8751 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)Br 62a_100000183597_100012356285 [0,2,0,0,0,0|1,1,0]=4 8752 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)Br 62a_100012356285_100000183597 [0,2,0,0,0,0|1,1,0]=4 8753 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)C 62a_100000183597_100011847877 [0,2,0,0,0,0|1,1,0]=4 8754 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)C 62a_100011847877_100000183597 [0,2,0,0,0,0|1,1,0]=4 8755 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)Cl 62a_100000183597_100012353702 [0,2,0,0,0,0|1,1,0]=4 8756 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)Cl 62a_100012353702_100000183597 [0,2,0,0,0,0|1,1,0]=4 8757 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)F 62a_100000183597_100012047266 [0,2,0,0,0,0|1,1,0]=4 8758 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)F 62a_100012047266_100000183597 [0,2,0,0,0,0|1,1,0]=4 8759 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)N 62a_100000183597_100000750455 [0,2,0,0,0,0|1,1,0]=4 8760 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)N 62a_100000750455_100000183597 [0,2,0,0,0,0|1,1,0]=4 8761 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)O 62a_100000183597_100012361655 [0,2,0,0,0,0|1,1,0]=4 8762 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000183597 [0,2,0,0,0,0|1,1,0]=4 8763 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)Br 62a_100000183597_100009813585 [0,2,0,0,0,0|1,1,0]=4 8764 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100000183597 [0,2,0,0,0,0|1,1,0]=4 8765 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)C 62a_100000183597_100011215607 [0,2,0,0,0,0|1,1,0]=4 8766 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100000183597 [0,2,0,0,0,0|1,1,0]=4 8767 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000183597 [0,2,0,0,0,0|1,1,0]=4 8768 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)Cl 62a_100000183597_100000049509 [0,2,0,0,0,0|1,1,0]=4 8769 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)F 62a_100000183597_100011218330 [0,2,0,0,0,0|1,1,0]=4 8770 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100000183597 [0,2,0,0,0,0|1,1,0]=4 8771 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)N 62a_100000183597_100000211769 [0,2,0,0,0,0|1,1,0]=4 8772 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100000183597 [0,2,0,0,0,0|1,1,0]=4 8773 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)C)O 62a_100000183597_100000186361 [0,2,0,0,0,0|1,1,0]=4 8774 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)Br 62a_100000183597_100012047281 [0,2,0,0,0,0|1,1,0]=4 8775 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)Br 62a_100012047281_100000183597 [0,2,0,0,0,0|1,1,0]=4 8776 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)C 62a_100000183597_100011216363 [0,2,0,0,0,0|1,1,0]=4 8777 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)C 62a_100011216363_100000183597 [0,2,0,0,0,0|1,1,0]=4 8778 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)Cl 62a_100000183597_100011214914 [0,2,0,0,0,0|1,1,0]=4 8779 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000183597 [0,2,0,0,0,0|1,1,0]=4 8780 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)F 62a_100000183597_100011215976 [0,2,0,0,0,0|1,1,0]=4 8781 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)F 62a_100011215976_100000183597 [0,2,0,0,0,0|1,1,0]=4 8782 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)N 62a_100000183597_100011218065 [0,2,0,0,0,0|1,1,0]=4 8783 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)N 62a_100011218065_100000183597 [0,2,0,0,0,0|1,1,0]=4 8784 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)O 62a_100000183597_100012360047 [0,2,0,0,0,0|1,1,0]=4 8785 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000183597 [0,2,0,0,0,0|1,1,0]=4 8786 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)Br 62a_100000183597_100000685389 [0,2,0,0,0,0|1,1,0]=4 8787 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)Br 62a_100000685389_100000183597 [0,2,0,0,0,0|1,1,0]=4 8788 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)C 62a_100000183597_100000720648 [0,2,0,0,0,0|1,1,0]=4 8789 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)C 62a_100000720648_100000183597 [0,2,0,0,0,0|1,1,0]=4 8790 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)Cl 62a_100000183597_100011216805 [0,2,0,0,0,0|1,1,0]=4 8791 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)Cl 62a_100011216805_100000183597 [0,2,0,0,0,0|1,1,0]=4 8792 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)F 1626a_100020586998_100000204393 [0,2,0,0,0,0|1,1,0]=4 8793 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)F 240690a_100020586998_100000204393 [0,2,0,0,0,0|1,1,0]=4 8794 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)F 527a_100020586998_100000204393 [0,2,0,0,0,0|1,1,0]=4 8795 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)F 62a_100000183597_100000703953 [0,2,0,0,0,0|1,1,0]=4 8796 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)F 62a_100000703953_100000183597 [0,2,0,0,0,0|1,1,0]=4 8797 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)N 62a_100000183597_100011215594 [0,2,0,0,0,0|1,1,0]=4 8798 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)N 62a_100011215594_100000183597 [0,2,0,0,0,0|1,1,0]=4 8799 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)O 62a_100000183597_100000185481 [0,2,0,0,0,0|1,1,0]=4 8800 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000183597 [0,2,0,0,0,0|1,1,0]=4 8801 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)Br 62a_100000183597_100000750456 [0,2,0,0,0,0|1,1,0]=4 8802 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)Br 62a_100000750456_100000183597 [0,2,0,0,0,0|1,1,0]=4 8803 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)C 62a_100000183597_100000761890 [0,2,0,0,0,0|1,1,0]=4 8804 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)C 62a_100000761890_100000183597 [0,2,0,0,0,0|1,1,0]=4 8805 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)Cl 62a_100000183597_200000761891 [0,2,0,0,0,0|1,1,0]=4 8806 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)Cl 62a_200000761891_100000183597 [0,2,0,0,0,0|1,1,0]=4 8807 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)F 62a_100000183597_100000740924 [0,2,0,0,0,0|1,1,0]=4 8808 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)F 62a_100000740924_100000183597 [0,2,0,0,0,0|1,1,0]=4 8809 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)N 62a_100000183597_100011534411 [0,2,0,0,0,0|1,1,0]=4 8810 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)N 62a_100000741789_100000183597 [0,2,0,0,0,0|1,1,0]=4 8811 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)O 62a_100000183597_100000752626 [0,2,0,0,0,0|1,1,0]=4 8812 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000183597 [0,2,0,0,0,0|1,1,0]=4 8813 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)Br 62a_100000183597_100012356990 [0,2,0,0,0,0|1,1,0]=4 8814 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000183597 [0,2,0,0,0,0|1,1,0]=4 8815 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)C 62a_100000183597_100000685420 [0,2,0,0,0,0|1,1,0]=4 8816 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000183597 [0,2,0,0,0,0|1,1,0]=4 8817 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)Cl 62a_100000183597_100011356854 [0,2,0,0,0,0|1,1,0]=4 8818 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000183597 [0,2,0,0,0,0|1,1,0]=4 8819 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)F 62a_100000183597_100000686035 [0,2,0,0,0,0|1,1,0]=4 8820 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000183597 [0,2,0,0,0,0|1,1,0]=4 8821 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)N 62a_100000183597_100000739049 [0,2,0,0,0,0|1,1,0]=4 8822 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000183597 [0,2,0,0,0,0|1,1,0]=4 8823 B16R1.20760 C=CCNC(=O)CSc1ccc(c(c1)O)O 62a_100000183597_100009813601 [0,2,0,0,0,0|1,1,0]=4 8824 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)Br 2230a_100011306057_100000033060 [0,2,0,0,0,0|1,0,0]=3 8825 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)Br 34a_100011306057_100000033060 [0,2,0,0,0,0|1,0,0]=3 8826 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)Br 7a_100011306057_100000033060 [0,2,0,0,0,0|1,0,0]=3 8827 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)C 2230a_100000736455_100000033060 [0,2,0,0,0,0|1,0,0]=3 8828 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)C 34a_100000736455_100000033060 [0,2,0,0,0,0|1,0,0]=3 8829 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)C 7a_100000736455_100000033060 [0,2,0,0,0,0|1,0,0]=3 8830 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000033060 [0,2,0,0,0,0|1,0,0]=3 8831 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)Cl 34a_100000686031_100000033060 [0,2,0,0,0,0|1,0,0]=3 8832 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)F 2230a_100000760356_100000033060 [0,2,0,0,0,0|1,0,0]=3 8833 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)F 34a_100000760356_100000033060 [0,2,0,0,0,0|1,0,0]=3 8834 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)F 7a_100000760356_100000033060 [0,2,0,0,0,0|1,0,0]=3 8835 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)I 34a_100000750458_100000033060 [0,2,0,0,0,0|1,0,0]=3 8836 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000033060 [0,2,0,0,0,0|1,0,0]=3 8837 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000033060 [0,2,0,0,0,0|1,0,0]=3 8838 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Br 34a_100000210723_100000033060 [0,2,0,0,0,0|1,0,0]=3 8839 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Br 7a_100000210723_100000033060 [0,2,0,0,0,0|1,0,0]=3 8840 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)C 2230a_100000724040_100000033060 [0,2,0,0,0,0|1,0,0]=3 8841 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)C 34a_100000724040_100000033060 [0,2,0,0,0,0|1,0,0]=3 8842 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)C 7a_100000724040_100000033060 [0,2,0,0,0,0|1,0,0]=3 8843 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000033060 [0,2,0,0,0,0|1,0,0]=3 8844 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Cl 34a_100000187808_100000033060 [0,2,0,0,0,0|1,0,0]=3 8845 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000033060 [0,2,0,0,0,0|1,0,0]=3 8846 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)F 2230a_100000750164_100000033060 [0,2,0,0,0,0|1,0,0]=3 8847 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)F 34a_100000750164_100000033060 [0,2,0,0,0,0|1,0,0]=3 8848 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)F 7a_100000750164_100000033060 [0,2,0,0,0,0|1,0,0]=3 8849 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)I 34a_100000198070_100000033060 [0,2,0,0,0,0|1,0,0]=3 8850 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)I 7a_100000198070_100000033060 [0,2,0,0,0,0|1,0,0]=3 8851 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000033060 [0,2,0,0,0,0|1,0,0]=3 8852 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000033060 [0,2,0,0,0,0|1,0,0]=3 8853 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000033060 [0,2,0,0,0,0|1,0,0]=3 8854 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)Br 34a_100000687081_100000033060 [0,2,0,0,0,0|1,0,0]=3 8855 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)Br 7a_100000687081_100000033060 [0,2,0,0,0,0|1,0,0]=3 8856 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)C 2230a_100000188892_100000033060 [0,2,0,0,0,0|1,0,0]=3 8857 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)C 34a_100000188892_100000033060 [0,2,0,0,0,0|1,0,0]=3 8858 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)C 7a_100000188892_100000033060 [0,2,0,0,0,0|1,0,0]=3 8859 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000033060 [0,2,0,0,0,0|1,0,0]=3 8860 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000033060 [0,2,0,0,0,0|1,0,0]=3 8861 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)F 2230a_100000211060_100000033060 [0,2,0,0,0,0|1,0,0]=3 8862 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)F 34a_100000211060_100000033060 [0,2,0,0,0,0|1,0,0]=3 8863 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)F 7a_100000211060_100000033060 [0,2,0,0,0,0|1,0,0]=3 8864 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)I 34a_100000761885_100000033060 [0,2,0,0,0,0|1,0,0]=3 8865 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000033060 [0,2,0,0,0,0|1,0,0]=3 8866 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Br 2230a_100000759894_100000033060 [0,2,0,0,0,0|1,0,0]=3 8867 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Br 34a_100000759894_100000033060 [0,2,0,0,0,0|1,0,0]=3 8868 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Br 7a_100000759894_100000033060 [0,2,0,0,0,0|1,0,0]=3 8869 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)C 2230a_100000210958_100000033060 [0,2,0,0,0,0|1,0,0]=3 8870 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)C 34a_100000210958_100000033060 [0,2,0,0,0,0|1,0,0]=3 8871 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)C 7a_100000210958_100000033060 [0,2,0,0,0,0|1,0,0]=3 8872 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Cl 2230a_100000739366_100000033060 [0,2,0,0,0,0|1,0,0]=3 8873 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Cl 34a_100000739366_100000033060 [0,2,0,0,0,0|1,0,0]=3 8874 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)Cl 7a_100000739366_100000033060 [0,2,0,0,0,0|1,0,0]=3 8875 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)F 2230a_100000210724_100000033060 [0,2,0,0,0,0|1,0,0]=3 8876 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)F 34a_100000210724_100000033060 [0,2,0,0,0,0|1,0,0]=3 8877 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)F 7a_100000210724_100000033060 [0,2,0,0,0,0|1,0,0]=3 8878 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)I 34a_100011356925_100000033060 [0,2,0,0,0,0|1,0,0]=3 8879 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)I 7a_100011356925_100000033060 [0,2,0,0,0,0|1,0,0]=3 8880 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000033060 [0,2,0,0,0,0|1,0,0]=3 8881 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000033060 [0,2,0,0,0,0|1,0,0]=3 8882 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)Br 34a_100000750459_100000033060 [0,2,0,0,0,0|1,0,0]=3 8883 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)C 34a_100000184131_100000033060 [0,2,0,0,0,0|1,0,0]=3 8884 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)C 7a_100000184131_100000033060 [0,2,0,0,0,0|1,0,0]=3 8885 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)Cl 34a_100012360549_100000033060 [0,2,0,0,0,0|1,0,0]=3 8886 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)F 34a_114828291077_100000033060 [0,2,0,0,0,0|1,0,0]=3 8887 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)I)F 7a_114828291077_100000033060 [0,2,0,0,0,0|1,0,0]=3 8888 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100000033060 [0,2,0,0,0,0|1,0,0]=3 8889 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000033060 [0,2,0,0,0,0|1,0,0]=3 8890 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000033060 [0,2,0,0,0,0|1,0,0]=3 8891 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000033060 [0,2,0,0,0,0|1,0,0]=3 8892 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000033060 [0,2,0,0,0,0|1,0,0]=3 8893 B16R1.20760 C=CCOC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000033060 [0,2,0,0,0,0|1,0,0]=3 8894 B16R1.20760 C=CCOC(=O)COc1cc(c(cn1)Br)C 34a_100000766222_100000033060 [0,2,0,0,0,0|1,0,0]=3 8895 B16R1.20760 C=CCOC(=O)COc1cc(c(cn1)Br)Cl 34a_100010369989_100000033060 [0,2,0,0,0,0|1,0,0]=3 8896 B16R1.20760 C=CCOC(=O)COc1cc(c(cn1)C)Br 34a_100009831917_100000033060 [0,2,0,0,0,0|1,0,0]=3 8897 B16R1.20760 C=CCOC(=O)COc1cc(c(cn1)Cl)C 34a_200000085746_100000033060 [0,2,0,0,0,0|1,0,0]=3 8898 B16R1.20760 C=CCOC(=O)COc1cc(c(cn1)Cl)Cl 34a_200000099200_100000033060 [0,2,0,0,0,0|1,0,0]=3 8899 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)C 34a_100011380479_100000033060 [0,2,0,0,0,0|0,0,0]=2 8900 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)C 7a_100011380479_100000033060 [0,2,0,0,0,0|0,0,0]=2 8901 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)Cl 34a_100011933957_100000033060 [0,2,0,0,0,0|0,0,0]=2 8902 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000033060 [0,2,0,0,0,0|0,0,0]=2 8903 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)F 34a_100000693481_100000033060 [0,2,0,0,0,0|0,0,0]=2 8904 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)F 7a_100000693481_100000033060 [0,2,0,0,0,0|0,0,0]=2 8905 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)I 34a_100000701344_100000033060 [0,2,0,0,0,0|0,0,0]=2 8906 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)I 7a_100000701344_100000033060 [0,2,0,0,0,0|0,0,0]=2 8907 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)N 34a_100012001276_100000033060 [0,2,0,0,0,0|0,0,0]=2 8908 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Br)N 7a_100012001276_100000033060 [0,2,0,0,0,0|0,0,0]=2 8909 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)Br 34a_100000690111_100000033060 [0,2,0,0,0,0|0,0,0]=2 8910 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_100000033060 [0,2,0,0,0,0|0,0,0]=2 8911 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)C 34a_100000210932_100000033060 [0,2,0,0,0,0|0,0,0]=2 8912 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)C 7a_100000210932_100000033060 [0,2,0,0,0,0|0,0,0]=2 8913 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)Cl 34a_100000211092_100000033060 [0,2,0,0,0,0|0,0,0]=2 8914 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_100000033060 [0,2,0,0,0,0|0,0,0]=2 8915 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)F 34a_100000751312_100000033060 [0,2,0,0,0,0|0,0,0]=2 8916 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)F 7a_100000751312_100000033060 [0,2,0,0,0,0|0,0,0]=2 8917 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)I 34a_100000729255_100000033060 [0,2,0,0,0,0|0,0,0]=2 8918 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)I 7a_100000729255_100000033060 [0,2,0,0,0,0|0,0,0]=2 8919 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)N 34a_100000756630_100000033060 [0,2,0,0,0,0|0,0,0]=2 8920 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)C)N 7a_100000756630_100000033060 [0,2,0,0,0,0|0,0,0]=2 8921 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)Br 34a_100011215161_100000033060 [0,2,0,0,0,0|0,0,0]=2 8922 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000033060 [0,2,0,0,0,0|0,0,0]=2 8923 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)C 34a_100011265682_100000033060 [0,2,0,0,0,0|0,0,0]=2 8924 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)C 7a_100011265682_100000033060 [0,2,0,0,0,0|0,0,0]=2 8925 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100000033060 [0,2,0,0,0,0|0,0,0]=2 8926 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000033060 [0,2,0,0,0,0|0,0,0]=2 8927 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)F 34a_100000211030_100000033060 [0,2,0,0,0,0|0,0,0]=2 8928 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)F 7a_100000211030_100000033060 [0,2,0,0,0,0|0,0,0]=2 8929 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)I 34a_100000047559_100000033060 [0,2,0,0,0,0|0,0,0]=2 8930 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)I 7a_100000047559_100000033060 [0,2,0,0,0,0|0,0,0]=2 8931 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)N 34a_100011215599_100000033060 [0,2,0,0,0,0|0,0,0]=2 8932 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)Cl)N 7a_100011215599_100000033060 [0,2,0,0,0,0|0,0,0]=2 8933 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)Br 34a_100000755031_100000033060 [0,2,0,0,0,0|0,0,0]=2 8934 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)Br 7a_100000755031_100000033060 [0,2,0,0,0,0|0,0,0]=2 8935 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)C 34a_100000722560_100000033060 [0,2,0,0,0,0|0,0,0]=2 8936 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)C 7a_100000722560_100000033060 [0,2,0,0,0,0|0,0,0]=2 8937 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)Cl 34a_100000691581_100000033060 [0,2,0,0,0,0|0,0,0]=2 8938 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)Cl 7a_100000691581_100000033060 [0,2,0,0,0,0|0,0,0]=2 8939 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)F 34a_100000181275_100000033060 [0,2,0,0,0,0|0,0,0]=2 8940 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)F 7a_100000181275_100000033060 [0,2,0,0,0,0|0,0,0]=2 8941 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)I 34a_100009990212_100000033060 [0,2,0,0,0,0|0,0,0]=2 8942 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)I 7a_100009990212_100000033060 [0,2,0,0,0,0|0,0,0]=2 8943 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)N 34a_100000759473_100000033060 [0,2,0,0,0,0|0,0,0]=2 8944 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)F)N 7a_100000759473_100000033060 [0,2,0,0,0,0|0,0,0]=2 8945 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)Br 34a_100012339312_100000033060 [0,2,0,0,0,0|0,0,0]=2 8946 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)Br 7a_100012339312_100000033060 [0,2,0,0,0,0|0,0,0]=2 8947 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)Cl 34a_100000049588_100000033060 [0,2,0,0,0,0|0,0,0]=2 8948 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)Cl 7a_100000049588_100000033060 [0,2,0,0,0,0|0,0,0]=2 8949 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)N 34a_100010084370_100000033060 [0,2,0,0,0,0|0,0,0]=2 8950 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)I)N 7a_100010084370_100000033060 [0,2,0,0,0,0|0,0,0]=2 8951 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)Br 34a_100011999798_100000033060 [0,2,0,0,0,0|0,0,0]=2 8952 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)Br 7a_100011999798_100000033060 [0,2,0,0,0,0|0,0,0]=2 8953 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)C 34a_100011216113_100000033060 [0,2,0,0,0,0|0,0,0]=2 8954 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)C 7a_100011216113_100000033060 [0,2,0,0,0,0|0,0,0]=2 8955 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)Cl 34a_100011934297_100000033060 [0,2,0,0,0,0|0,0,0]=2 8956 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)F 34a_100012017239_100000033060 [0,2,0,0,0,0|0,0,0]=2 8957 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)F 7a_100012017239_100000033060 [0,2,0,0,0,0|0,0,0]=2 8958 B16R1.20760 C=CCOC(=O)COc1ccc(c(c1)N)N 34a_100025771000_100000033060 [0,2,0,0,0,0|0,0,0]=2 8959 B16R1.20760 C=CCOC(=O)COc1ccc(c(n1)C)Br 34a_100000691680_100000033060 [0,2,0,0,0,0|1,0,0]=3 8960 B16R1.20760 C=CCOC(=O)COc1ccc(c(n1)C)Cl 34a_200009863735_100000033060 [0,2,0,0,0,0|1,0,0]=3 8961 B16R1.20760 C=CCOC(=O)COc1ccc(c(n1)F)Br 34a_100009879308_100000033060 [0,2,0,0,0,0|1,0,0]=3 8962 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)C 34a_100009819603_100000033060 [0,2,0,0,0,0|1,0,0]=3 8963 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)C 7a_100009819603_100000033060 [0,2,0,0,0,0|1,0,0]=3 8964 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)Cl 34a_100012356455_100000033060 [0,2,0,0,0,0|1,0,0]=3 8965 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)Cl 7a_100012356455_100000033060 [0,2,0,0,0,0|1,0,0]=3 8966 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)F 34a_100009817267_100000033060 [0,2,0,0,0,0|1,0,0]=3 8967 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Br)F 7a_100009817267_100000033060 [0,2,0,0,0,0|1,0,0]=3 8968 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)Br 34a_100012000486_100000033060 [0,2,0,0,0,0|1,0,0]=3 8969 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)Br 7a_100012000486_100000033060 [0,2,0,0,0,0|1,0,0]=3 8970 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)C 34a_100009854398_100000033060 [0,2,0,0,0,0|1,0,0]=3 8971 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)C 7a_100009854398_100000033060 [0,2,0,0,0,0|1,0,0]=3 8972 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)Cl 34a_100012002680_100000033060 [0,2,0,0,0,0|1,0,0]=3 8973 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)Cl 7a_100012002680_100000033060 [0,2,0,0,0,0|1,0,0]=3 8974 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)F 34a_100000094615_100000033060 [0,2,0,0,0,0|1,0,0]=3 8975 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)C)F 7a_100000094615_100000033060 [0,2,0,0,0,0|1,0,0]=3 8976 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)Br 34a_100010209684_100000033060 [0,2,0,0,0,0|1,0,0]=3 8977 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)Br 7a_100010209684_100000033060 [0,2,0,0,0,0|1,0,0]=3 8978 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)Cl 34a_100000094354_100000033060 [0,2,0,0,0,0|1,0,0]=3 8979 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)Cl 7a_100000094354_100000033060 [0,2,0,0,0,0|1,0,0]=3 8980 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)F 34a_100000087088_100000033060 [0,2,0,0,0,0|1,0,0]=3 8981 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)Cl)F 7a_100000087088_100000033060 [0,2,0,0,0,0|1,0,0]=3 8982 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)F)Cl 34a_100000063512_100000033060 [0,2,0,0,0,0|1,0,0]=3 8983 B16R1.20760 C=CCOC(=O)COc1cnc(c(c1)F)Cl 7a_100000063512_100000033060 [0,2,0,0,0,0|1,0,0]=3 8984 B16R1.20760 C=CCOC(=O)COc1cnc(c(n1)C)C 34a_200000700380_100000033060 [0,2,0,0,0,0|2,0,0]=4 8985 B16R1.20760 C=CCOC(=O)COc1cnc(c(n1)Cl)Br 34a_100010080449_100000033060 [0,2,0,0,0,0|2,0,0]=4 8986 B16R1.20760 C=CCOC(=O)CSc1c[nH]c(=O)c(c1)Br 62a_100000033060_100010125443 [0,2,0,0,0,0|1,1,0]=4 8987 B16R1.20760 C=CCOC(=O)CSc1c[nH]c(=O)c(c1)Br 62a_100010125443_100000033060 [0,2,0,0,0,0|1,1,0]=4 8988 B16R1.20760 C=CCOC(=O)CSc1c[nH]c(=O)c(c1)F 62a_100000033060_100000723523 [0,2,0,0,0,0|1,1,0]=4 8989 B16R1.20760 C=CCOC(=O)CSc1c[nH]c(=O)c(c1)F 62a_100000723523_100000033060 [0,2,0,0,0,0|1,1,0]=4 8990 B16R1.20760 C=CCOC(=O)CSc1c[nH]c(=O)c(c1)O 62a_100000033060_100009814561 [0,2,0,0,0,0|1,1,0]=4 8991 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)Br)C 62a_100000033060_100012356354 [0,2,0,0,0,0|1,1,0]=4 8992 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)Br)C 62a_100012356354_100000033060 [0,2,0,0,0,0|1,1,0]=4 8993 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)C 62a_100000033060_100009850809 [0,2,0,0,0,0|1,1,0]=4 8994 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)C 62a_100009850809_100000033060 [0,2,0,0,0,0|1,1,0]=4 8995 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)F 62a_100000033060_100009841206 [0,2,0,0,0,0|1,1,0]=4 8996 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)F 62a_100009841206_100000033060 [0,2,0,0,0,0|1,1,0]=4 8997 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)N 62a_100000033060_100000126663 [0,2,0,0,0,0|1,1,0]=4 8998 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)N 62a_100000126663_100000033060 [0,2,0,0,0,0|1,1,0]=4 8999 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)O 62a_100000033060_100000704368 [0,2,0,0,0,0|1,1,0]=4 9000 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)C)O 62a_100000704368_100000033060 [0,2,0,0,0,0|1,1,0]=4 9001 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)C 62a_100000033060_100009818257 [0,2,0,0,0,0|1,1,0]=4 9002 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)C 62a_100009818257_100000033060 [0,2,0,0,0,0|1,1,0]=4 9003 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)N 62a_100000033060_100000126464 [0,2,0,0,0,0|1,1,0]=4 9004 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)N 62a_100000126464_100000033060 [0,2,0,0,0,0|1,1,0]=4 9005 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)O 62a_100000033060_100009854642 [0,2,0,0,0,0|1,1,0]=4 9006 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)F)O 62a_100009854642_100000033060 [0,2,0,0,0,0|1,1,0]=4 9007 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)N)C 62a_100000033060_100000067204 [0,2,0,0,0,0|1,1,0]=4 9008 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)N)C 62a_100000067204_100000033060 [0,2,0,0,0,0|1,1,0]=4 9009 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)N)N 62a_100000033060_100000067514 [0,2,0,0,0,0|1,1,0]=4 9010 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)N)N 62a_100000067514_100000033060 [0,2,0,0,0,0|1,1,0]=4 9011 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)O)C 62a_100000033060_100000692680 [0,2,0,0,0,0|1,1,0]=4 9012 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)O)N 62a_100000033060_100009819941 [0,2,0,0,0,0|1,1,0]=4 9013 B16R1.20760 C=CCOC(=O)CSc1cc(c(cn1)O)N 62a_100009819941_100000033060 [0,2,0,0,0,0|1,1,0]=4 9014 B16R1.20760 C=CCOC(=O)CSc1ccc(=O)n(c1)C 62a_100000033060_100011245003 [0,2,0,0,0,0|1,1,0]=4 9015 B16R1.20760 C=CCOC(=O)CSc1ccc(=O)n(c1)C 62a_100011245003_100000033060 [0,2,0,0,0,0|1,1,0]=4 9016 B16R1.20760 C=CCOC(=O)CSc1ccc([n+](c1)[O-])C 62a_100000033060_100000703231 [0,2,0,0,0,0|1,1,0]=4 9017 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)Br 62a_100000033060_100012356285 [0,2,0,0,0,0|0,1,0]=3 9018 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)Br 62a_100012356285_100000033060 [0,2,0,0,0,0|0,1,0]=3 9019 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)C 62a_100000033060_100011847877 [0,2,0,0,0,0|0,1,0]=3 9020 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)C 62a_100011847877_100000033060 [0,2,0,0,0,0|0,1,0]=3 9021 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)Cl 62a_100000033060_100012353702 [0,2,0,0,0,0|0,1,0]=3 9022 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)Cl 62a_100012353702_100000033060 [0,2,0,0,0,0|0,1,0]=3 9023 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)F 62a_100000033060_100012047266 [0,2,0,0,0,0|0,1,0]=3 9024 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)F 62a_100012047266_100000033060 [0,2,0,0,0,0|0,1,0]=3 9025 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)N 62a_100000033060_100000750455 [0,2,0,0,0,0|0,1,0]=3 9026 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)N 62a_100000750455_100000033060 [0,2,0,0,0,0|0,1,0]=3 9027 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)O 62a_100000033060_100012361655 [0,2,0,0,0,0|0,1,0]=3 9028 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000033060 [0,2,0,0,0,0|0,1,0]=3 9029 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)Br 62a_100000033060_100009813585 [0,2,0,0,0,0|0,1,0]=3 9030 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100000033060 [0,2,0,0,0,0|0,1,0]=3 9031 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)C 62a_100000033060_100011215607 [0,2,0,0,0,0|0,1,0]=3 9032 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100000033060 [0,2,0,0,0,0|0,1,0]=3 9033 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)Cl 62a_100000033060_100000049509 [0,2,0,0,0,0|0,1,0]=3 9034 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000033060 [0,2,0,0,0,0|0,1,0]=3 9035 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)F 62a_100000033060_100011218330 [0,2,0,0,0,0|0,1,0]=3 9036 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100000033060 [0,2,0,0,0,0|0,1,0]=3 9037 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)N 62a_100000033060_100000211769 [0,2,0,0,0,0|0,1,0]=3 9038 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100000033060 [0,2,0,0,0,0|0,1,0]=3 9039 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)C)O 62a_100000033060_100000186361 [0,2,0,0,0,0|0,1,0]=3 9040 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)Br 62a_100000033060_100012047281 [0,2,0,0,0,0|0,1,0]=3 9041 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)Br 62a_100012047281_100000033060 [0,2,0,0,0,0|0,1,0]=3 9042 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)C 62a_100000033060_100011216363 [0,2,0,0,0,0|0,1,0]=3 9043 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)C 62a_100011216363_100000033060 [0,2,0,0,0,0|0,1,0]=3 9044 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)Cl 62a_100000033060_100011214914 [0,2,0,0,0,0|0,1,0]=3 9045 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000033060 [0,2,0,0,0,0|0,1,0]=3 9046 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)F 62a_100000033060_100011215976 [0,2,0,0,0,0|0,1,0]=3 9047 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)F 62a_100011215976_100000033060 [0,2,0,0,0,0|0,1,0]=3 9048 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)N 62a_100000033060_100011218065 [0,2,0,0,0,0|0,1,0]=3 9049 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)N 62a_100011218065_100000033060 [0,2,0,0,0,0|0,1,0]=3 9050 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)O 62a_100000033060_100012360047 [0,2,0,0,0,0|0,1,0]=3 9051 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000033060 [0,2,0,0,0,0|0,1,0]=3 9052 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)Br 62a_100000033060_100000685389 [0,2,0,0,0,0|0,1,0]=3 9053 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)Br 62a_100000685389_100000033060 [0,2,0,0,0,0|0,1,0]=3 9054 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)C 62a_100000033060_100000720648 [0,2,0,0,0,0|0,1,0]=3 9055 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)C 62a_100000720648_100000033060 [0,2,0,0,0,0|0,1,0]=3 9056 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)Cl 62a_100000033060_100011216805 [0,2,0,0,0,0|0,1,0]=3 9057 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)Cl 62a_100011216805_100000033060 [0,2,0,0,0,0|0,1,0]=3 9058 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)F 62a_100000033060_100000703953 [0,2,0,0,0,0|0,1,0]=3 9059 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)F 62a_100000703953_100000033060 [0,2,0,0,0,0|0,1,0]=3 9060 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)N 62a_100000033060_100011215594 [0,2,0,0,0,0|0,1,0]=3 9061 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)N 62a_100011215594_100000033060 [0,2,0,0,0,0|0,1,0]=3 9062 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)O 62a_100000033060_100000185481 [0,2,0,0,0,0|0,1,0]=3 9063 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000033060 [0,2,0,0,0,0|0,1,0]=3 9064 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)Br 62a_100000033060_100000750456 [0,2,0,0,0,0|0,1,0]=3 9065 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)Br 62a_100000750456_100000033060 [0,2,0,0,0,0|0,1,0]=3 9066 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)C 62a_100000033060_100000761890 [0,2,0,0,0,0|0,1,0]=3 9067 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)C 62a_100000761890_100000033060 [0,2,0,0,0,0|0,1,0]=3 9068 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)Cl 62a_100000033060_200000761891 [0,2,0,0,0,0|0,1,0]=3 9069 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)Cl 62a_200000761891_100000033060 [0,2,0,0,0,0|0,1,0]=3 9070 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)F 62a_100000033060_100000740924 [0,2,0,0,0,0|0,1,0]=3 9071 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)F 62a_100000740924_100000033060 [0,2,0,0,0,0|0,1,0]=3 9072 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)N 62a_100000033060_100011534411 [0,2,0,0,0,0|0,1,0]=3 9073 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)N 62a_100000741789_100000033060 [0,2,0,0,0,0|0,1,0]=3 9074 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)O 62a_100000033060_100000752626 [0,2,0,0,0,0|0,1,0]=3 9075 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000033060 [0,2,0,0,0,0|0,1,0]=3 9076 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)Br 62a_100000033060_100012356990 [0,2,0,0,0,0|0,1,0]=3 9077 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000033060 [0,2,0,0,0,0|0,1,0]=3 9078 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)C 62a_100000033060_100000685420 [0,2,0,0,0,0|0,1,0]=3 9079 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000033060 [0,2,0,0,0,0|0,1,0]=3 9080 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)Cl 62a_100000033060_100011356854 [0,2,0,0,0,0|0,1,0]=3 9081 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000033060 [0,2,0,0,0,0|0,1,0]=3 9082 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)F 62a_100000033060_100000686035 [0,2,0,0,0,0|0,1,0]=3 9083 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000033060 [0,2,0,0,0,0|0,1,0]=3 9084 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)N 62a_100000033060_100000739049 [0,2,0,0,0,0|0,1,0]=3 9085 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000033060 [0,2,0,0,0,0|0,1,0]=3 9086 B16R1.20760 C=CCOC(=O)CSc1ccc(c(c1)O)O 62a_100000033060_100009813601 [0,2,0,0,0,0|0,1,0]=3 9087 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)Br)O 62a_100000033060_100000725334 [0,2,0,0,0,0|1,1,0]=4 9088 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)Br)O 62a_100000725334_100000033060 [0,2,0,0,0,0|1,1,0]=4 9089 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)Br 62a_100000033060_100012360386 [0,2,0,0,0,0|1,1,0]=4 9090 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)Br 62a_100012360386_100000033060 [0,2,0,0,0,0|1,1,0]=4 9091 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)C 62a_100000033060_100000103781 [0,2,0,0,0,0|1,1,0]=4 9092 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)C 62a_100000103781_100000033060 [0,2,0,0,0,0|1,1,0]=4 9093 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)F 62a_100000033060_100009814307 [0,2,0,0,0,0|1,1,0]=4 9094 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)F 62a_100009814307_100000033060 [0,2,0,0,0,0|1,1,0]=4 9095 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)N 62a_100000033060_100000720120 [0,2,0,0,0,0|1,1,0]=4 9096 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)N 62a_100000720120_100000033060 [0,2,0,0,0,0|1,1,0]=4 9097 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)O 62a_100000033060_100010233687 [0,2,0,0,0,0|1,1,0]=4 9098 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)C)O 62a_100010233687_100000033060 [0,2,0,0,0,0|1,1,0]=4 9099 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)Cl)N 62a_100000033060_200010233646 [0,2,0,0,0,0|1,1,0]=4 9100 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)Cl)N 62a_200010233646_100000033060 [0,2,0,0,0,0|1,1,0]=4 9101 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)Cl)O 62a_100000033060_100000721234 [0,2,0,0,0,0|1,1,0]=4 9102 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)Br 62a_100000033060_100010134343 [0,2,0,0,0,0|1,1,0]=4 9103 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)Br 62a_100010134343_100000033060 [0,2,0,0,0,0|1,1,0]=4 9104 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)N 62a_100000033060_100009856439 [0,2,0,0,0,0|1,1,0]=4 9105 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)N 62a_100009856439_100000033060 [0,2,0,0,0,0|1,1,0]=4 9106 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)O 62a_100000033060_100009819667 [0,2,0,0,0,0|1,1,0]=4 9107 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)F)O 62a_100009819667_100000033060 [0,2,0,0,0,0|1,1,0]=4 9108 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)C 62a_100000033060_100009857032 [0,2,0,0,0,0|1,1,0]=4 9109 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)C 62a_100009857032_100000033060 [0,2,0,0,0,0|1,1,0]=4 9110 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)F 62a_100000033060_100016091773 [0,2,0,0,0,0|1,1,0]=4 9111 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)F 62a_100016091773_100000033060 [0,2,0,0,0,0|1,1,0]=4 9112 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)N 62a_100000747239_100000033060 [0,2,0,0,0,0|1,1,0]=4 9113 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)O 62a_100000033060_100000685527 [0,2,0,0,0,0|1,1,0]=4 9114 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)N)O 62a_100000685527_100000033060 [0,2,0,0,0,0|1,1,0]=4 9115 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)O)F 62a_100000033060_100010729010 [0,2,0,0,0,0|1,1,0]=4 9116 B16R1.20760 C=CCOC(=O)CSc1ccc(c(n1)O)N 62a_100000718904_100000033060 [0,2,0,0,0,0|1,1,0]=4 9117 B16R1.20760 C=CCOC(=O)CSc1ccn(c(=O)c1)C 62a_100000033060_100009820031 [0,2,0,0,0,0|1,1,0]=4 9118 B16R1.20760 C=CCOC(=O)CSc1ccn(c(=O)c1)C 62a_100009820031_100000033060 [0,2,0,0,0,0|1,1,0]=4 9119 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Br)Cl 62a_100000033060_100010172733 [0,2,0,0,0,0|1,1,0]=4 9120 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Br)Cl 62a_100010172733_100000033060 [0,2,0,0,0,0|1,1,0]=4 9121 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Br)N 62a_100000033060_100012353989 [0,2,0,0,0,0|1,1,0]=4 9122 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Br)N 62a_100012353989_100000033060 [0,2,0,0,0,0|1,1,0]=4 9123 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)Br 62a_100000033060_100009816107 [0,2,0,0,0,0|1,1,0]=4 9124 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)Br 62a_100009816107_100000033060 [0,2,0,0,0,0|1,1,0]=4 9125 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)C 62a_100000033060_100000697892 [0,2,0,0,0,0|1,1,0]=4 9126 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)C 62a_100000697892_100000033060 [0,2,0,0,0,0|1,1,0]=4 9127 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)Cl 62a_100000033060_100009922867 [0,2,0,0,0,0|1,1,0]=4 9128 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)Cl 62a_100009922867_100000033060 [0,2,0,0,0,0|1,1,0]=4 9129 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)F 62a_100000033060_100000709442 [0,2,0,0,0,0|1,1,0]=4 9130 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)F 62a_100000709442_100000033060 [0,2,0,0,0,0|1,1,0]=4 9131 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)N 62a_100000033060_100000684428 [0,2,0,0,0,0|1,1,0]=4 9132 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)N 62a_100000684428_100000033060 [0,2,0,0,0,0|1,1,0]=4 9133 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)O 62a_100000033060_100000685391 [0,2,0,0,0,0|1,1,0]=4 9134 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)C)O 62a_100000685391_100000033060 [0,2,0,0,0,0|1,1,0]=4 9135 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Cl)N 62a_100000033060_100012356299 [0,2,0,0,0,0|1,1,0]=4 9136 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Cl)N 62a_100012356299_100000033060 [0,2,0,0,0,0|1,1,0]=4 9137 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Cl)O 62a_100000033060_100010238531 [0,2,0,0,0,0|1,1,0]=4 9138 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)Cl)O 62a_100010238531_100000033060 [0,2,0,0,0,0|1,1,0]=4 9139 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)C 62a_100000033060_100009845756 [0,2,0,0,0,0|1,1,0]=4 9140 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)C 62a_100009845756_100000033060 [0,2,0,0,0,0|1,1,0]=4 9141 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)F 62a_100000033060_100009817721 [0,2,0,0,0,0|1,1,0]=4 9142 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)F 62a_100009817721_100000033060 [0,2,0,0,0,0|1,1,0]=4 9143 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)N 62a_100000033060_100000693161 [0,2,0,0,0,0|1,1,0]=4 9144 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)F)N 62a_100000693161_100000033060 [0,2,0,0,0,0|1,1,0]=4 9145 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)C 62a_100000033060_100011999542 [0,2,0,0,0,0|1,1,0]=4 9146 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)C 62a_100011999542_100000033060 [0,2,0,0,0,0|1,1,0]=4 9147 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)Cl 62a_100000033060_100009828400 [0,2,0,0,0,0|1,1,0]=4 9148 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)Cl 62a_100009828400_100000033060 [0,2,0,0,0,0|1,1,0]=4 9149 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)F 62a_100000033060_100009816798 [0,2,0,0,0,0|1,1,0]=4 9150 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)F 62a_100009816798_100000033060 [0,2,0,0,0,0|1,1,0]=4 9151 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)N 62a_100000033060_100000184470 [0,2,0,0,0,0|1,1,0]=4 9152 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)N 62a_100000184470_100000033060 [0,2,0,0,0,0|1,1,0]=4 9153 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)O 62a_100000033060_100000743729 [0,2,0,0,0,0|1,1,0]=4 9154 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)N)O 62a_100000743729_100000033060 [0,2,0,0,0,0|1,1,0]=4 9155 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)C 62a_100000033060_100009864810 [0,2,0,0,0,0|1,1,0]=4 9156 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)C 62a_100009864810_100000033060 [0,2,0,0,0,0|1,1,0]=4 9157 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)F 62a_100000033060_100009819871 [0,2,0,0,0,0|1,1,0]=4 9158 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)F 62a_100009819871_100000033060 [0,2,0,0,0,0|1,1,0]=4 9159 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)N 62a_100000033060_100009819042 [0,2,0,0,0,0|1,1,0]=4 9160 B16R1.20760 C=CCOC(=O)CSc1cnc(c(c1)O)N 62a_100009819042_100000033060 [0,2,0,0,0,0|1,1,0]=4 9161 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)C 34a_100011380479_200011215008 [0,2,0,0,0,0|0,0,2]=4 9162 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)C 7a_100011380479_200011215008 [0,2,0,0,0,0|0,0,2]=4 9163 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)Cl 34a_100011933957_200011215008 [0,2,0,0,0,0|0,0,2]=4 9164 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)Cl 7a_100011933957_200011215008 [0,2,0,0,0,0|0,0,2]=4 9165 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)F 34a_100000693481_200011215008 [0,2,0,0,0,0|0,0,2]=4 9166 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)F 7a_100000693481_200011215008 [0,2,0,0,0,0|0,0,2]=4 9167 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)I 34a_100000701344_200011215008 [0,2,0,0,0,0|0,0,2]=4 9168 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)I 7a_100000701344_200011215008 [0,2,0,0,0,0|0,0,2]=4 9169 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)N 34a_100012001276_200011215008 [0,2,0,0,0,0|0,0,2]=4 9170 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Br)N 7a_100012001276_200011215008 [0,2,0,0,0,0|0,0,2]=4 9171 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)Br 34a_100000690111_200011215008 [0,2,0,0,0,0|0,0,2]=4 9172 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_200011215008 [0,2,0,0,0,0|0,0,2]=4 9173 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)C 34a_100000210932_200011215008 [0,2,0,0,0,0|0,0,2]=4 9174 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)C 7a_100000210932_200011215008 [0,2,0,0,0,0|0,0,2]=4 9175 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)Cl 34a_100000211092_200011215008 [0,2,0,0,0,0|0,0,2]=4 9176 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_200011215008 [0,2,0,0,0,0|0,0,2]=4 9177 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)F 34a_100000751312_200011215008 [0,2,0,0,0,0|0,0,2]=4 9178 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)F 7a_100000751312_200011215008 [0,2,0,0,0,0|0,0,2]=4 9179 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)I 34a_100000729255_200011215008 [0,2,0,0,0,0|0,0,2]=4 9180 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)I 7a_100000729255_200011215008 [0,2,0,0,0,0|0,0,2]=4 9181 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)N 34a_100000756630_200011215008 [0,2,0,0,0,0|0,0,2]=4 9182 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)C)N 7a_100000756630_200011215008 [0,2,0,0,0,0|0,0,2]=4 9183 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)Br 34a_100011215161_200011215008 [0,2,0,0,0,0|0,0,2]=4 9184 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)Br 7a_100011215161_200011215008 [0,2,0,0,0,0|0,0,2]=4 9185 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)C 34a_100011265682_200011215008 [0,2,0,0,0,0|0,0,2]=4 9186 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)C 7a_100011265682_200011215008 [0,2,0,0,0,0|0,0,2]=4 9187 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)Cl 34a_100000211054_200011215008 [0,2,0,0,0,0|0,0,2]=4 9188 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)Cl 7a_100000211054_200011215008 [0,2,0,0,0,0|0,0,2]=4 9189 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)F 34a_100000211030_200011215008 [0,2,0,0,0,0|0,0,2]=4 9190 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)F 7a_100000211030_200011215008 [0,2,0,0,0,0|0,0,2]=4 9191 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)I 34a_100000047559_200011215008 [0,2,0,0,0,0|0,0,2]=4 9192 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)I 7a_100000047559_200011215008 [0,2,0,0,0,0|0,0,2]=4 9193 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)N 34a_100011215599_200011215008 [0,2,0,0,0,0|0,0,2]=4 9194 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)Cl)N 7a_100011215599_200011215008 [0,2,0,0,0,0|0,0,2]=4 9195 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)Br 34a_100000755031_200011215008 [0,2,0,0,0,0|0,0,2]=4 9196 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)Br 7a_100000755031_200011215008 [0,2,0,0,0,0|0,0,2]=4 9197 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)C 34a_100000722560_200011215008 [0,2,0,0,0,0|0,0,2]=4 9198 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)C 7a_100000722560_200011215008 [0,2,0,0,0,0|0,0,2]=4 9199 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)Cl 34a_100000691581_200011215008 [0,2,0,0,0,0|0,0,2]=4 9200 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)Cl 7a_100000691581_200011215008 [0,2,0,0,0,0|0,0,2]=4 9201 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)F 34a_100000181275_200011215008 [0,2,0,0,0,0|0,0,2]=4 9202 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)F 7a_100000181275_200011215008 [0,2,0,0,0,0|0,0,2]=4 9203 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)I 34a_100009990212_200011215008 [0,2,0,0,0,0|0,0,2]=4 9204 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)I 7a_100009990212_200011215008 [0,2,0,0,0,0|0,0,2]=4 9205 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)N 34a_100000759473_200011215008 [0,2,0,0,0,0|0,0,2]=4 9206 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)F)N 7a_100000759473_200011215008 [0,2,0,0,0,0|0,0,2]=4 9207 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)Br 34a_100012339312_200011215008 [0,2,0,0,0,0|0,0,2]=4 9208 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)Br 7a_100012339312_200011215008 [0,2,0,0,0,0|0,0,2]=4 9209 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)Cl 34a_100000049588_200011215008 [0,2,0,0,0,0|0,0,2]=4 9210 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)Cl 7a_100000049588_200011215008 [0,2,0,0,0,0|0,0,2]=4 9211 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)N 34a_100010084370_200011215008 [0,2,0,0,0,0|0,0,2]=4 9212 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)I)N 7a_100010084370_200011215008 [0,2,0,0,0,0|0,0,2]=4 9213 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)Br 34a_100011999798_200011215008 [0,2,0,0,0,0|0,0,2]=4 9214 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)Br 7a_100011999798_200011215008 [0,2,0,0,0,0|0,0,2]=4 9215 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)C 34a_100011216113_200011215008 [0,2,0,0,0,0|0,0,2]=4 9216 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)C 7a_100011216113_200011215008 [0,2,0,0,0,0|0,0,2]=4 9217 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)Cl 34a_100011934297_200011215008 [0,2,0,0,0,0|0,0,2]=4 9218 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)F 34a_100012017239_200011215008 [0,2,0,0,0,0|0,0,2]=4 9219 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)F 7a_100012017239_200011215008 [0,2,0,0,0,0|0,0,2]=4 9220 B16R1.20760 CCCOC(=O)COc1ccc(c(c1)N)N 34a_100025771000_200011215008 [0,2,0,0,0,0|0,0,2]=4 9221 B16R1.658 C=CCCC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_100000754431 [0,2,0,0,0,0|2,0,0]=4 9222 B16R1.658 C=CCCC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_100000754431 [0,2,0,0,0,0|2,0,0]=4 9223 B16R1.658 C=CCCC(=O)C(C)Oc1ccc(cc1)Br 1458a_100000181392_100000754431 [0,2,0,0,0,0|1,0,0]=3 9224 B16R1.658 C=CCCC(=O)C(C)Oc1ccc(cc1)C 1458a_100000183867_100000754431 [0,2,0,0,0,0|1,0,0]=3 9225 B16R1.658 C=CCCC(=O)C(C)Oc1ccc(cc1)Cl 1458a_100000184027_100000754431 [0,2,0,0,0,0|1,0,0]=3 9226 B16R1.658 C=CCCC(=O)C(C)Oc1ccc(cc1)F 1458a_100000203723_100000754431 [0,2,0,0,0,0|1,0,0]=3 9227 B16R1.658 C=CCCC(=O)C(C)Sc1ccc(cc1)C 1458a_100000181072_100000754431 [0,2,0,0,0,0|1,1,0]=4 9228 B16R1.658 C=CCCC(=O)C(C)Sc1ccc(cc1)Cl 1458a_100000178403_100000754431 [0,2,0,0,0,0|1,1,0]=4 9229 B16R1.658 C=CCCC(=O)C(C)Sc1ccc(cc1)F 1458a_100000181075_100000754431 [0,2,0,0,0,0|1,1,0]=4 9230 B16R1.658 C=CCCC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_100000754431 [0,2,0,0,0,0|2,0,0]=4 9231 B16R1.658 C=CCCC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_100000754431 [0,2,0,0,0,0|2,0,0]=4 9232 B16R1.658 C=CCCC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_100000754431 [0,2,0,0,0,0|2,0,0]=4 9233 B16R1.658 C=CCCC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_100000754431 [0,2,0,0,0,0|1,0,0]=3 9234 B16R1.658 C=CCCC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_100000754431 [0,2,0,0,0,0|2,0,0]=4 9235 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)Br 1626a_100020586998_100000695199 [0,2,0,0,0,0|2,0,0]=4 9236 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)Br 240690a_100020586998_100000695199 [0,2,0,0,0,0|2,0,0]=4 9237 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)Br 527a_100020586998_100000695199 [0,2,0,0,0,0|2,0,0]=4 9238 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)F 1626a_100020586998_100000746122 [0,2,0,0,0,0|2,0,0]=4 9239 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)F 240690a_100020586998_100000746122 [0,2,0,0,0,0|2,0,0]=4 9240 B16R1.658 C=CCNC(=O)C(C)Cc1ccc(cc1)F 527a_100020586998_100000746122 [0,2,0,0,0,0|2,0,0]=4 9241 B16R1.658 C=CCNC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100000230288 [0,2,0,0,0,0|2,0,0]=4 9242 B16R1.658 C=CCNC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000230288 [0,2,0,0,0,0|2,0,0]=4 9243 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Br 1626a_100020586998_100000181392 [0,2,0,0,0,0|1,0,0]=3 9244 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Br 240690a_100020586998_100000181392 [0,2,0,0,0,0|1,0,0]=3 9245 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Br 527a_100020586998_100000181392 [0,2,0,0,0,0|1,0,0]=3 9246 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000230288 [0,2,0,0,0,0|1,0,0]=3 9247 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)C 1626a_100020586998_100000183867 [0,2,0,0,0,0|1,0,0]=3 9248 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)C 240690a_100020586998_100000183867 [0,2,0,0,0,0|1,0,0]=3 9249 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)C 527a_100020586998_100000183867 [0,2,0,0,0,0|1,0,0]=3 9250 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000230288 [0,2,0,0,0,0|1,0,0]=3 9251 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Cl 1626a_100020586998_100000184027 [0,2,0,0,0,0|1,0,0]=3 9252 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Cl 240690a_100020586998_100000184027 [0,2,0,0,0,0|1,0,0]=3 9253 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Cl 527a_100020586998_100000184027 [0,2,0,0,0,0|1,0,0]=3 9254 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000230288 [0,2,0,0,0,0|1,0,0]=3 9255 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)F 1626a_100020586998_100000203723 [0,2,0,0,0,0|1,0,0]=3 9256 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)F 240690a_100020586998_100000203723 [0,2,0,0,0,0|1,0,0]=3 9257 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)F 527a_100020586998_100000203723 [0,2,0,0,0,0|1,0,0]=3 9258 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000230288 [0,2,0,0,0,0|1,0,0]=3 9259 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)Br 7a_100000685995_100000230288 [0,2,0,0,0,0|2,0,0]=4 9260 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)C 7a_100000745506_100000230288 [0,2,0,0,0,0|2,0,0]=4 9261 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)Cl 7a_100000744096_100000230288 [0,2,0,0,0,0|2,0,0]=4 9262 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)F 7a_100000688820_100000230288 [0,2,0,0,0,0|2,0,0]=4 9263 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)I 7a_100000687607_100000230288 [0,2,0,0,0,0|2,0,0]=4 9264 B16R1.658 C=CCNC(=O)C(C)Oc1ccc(nc1)N 7a_100015188713_100000230288 [0,2,0,0,0,0|2,0,0]=4 9265 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Br 62a_100000230288_100000752885 [0,2,0,0,0,0|1,1,0]=4 9266 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100000230288 [0,2,0,0,0,0|1,1,0]=4 9267 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)C 1626a_100020586998_100000181072 [0,2,0,0,0,0|1,1,0]=4 9268 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)C 240690a_100020586998_100000181072 [0,2,0,0,0,0|1,1,0]=4 9269 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)C 527a_100020586998_100000181072 [0,2,0,0,0,0|1,1,0]=4 9270 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100000230288 [0,2,0,0,0,0|1,1,0]=4 9271 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)C 62a_100000230288_100000186775 [0,2,0,0,0,0|1,1,0]=4 9272 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Cl 1626a_100020586998_100000178403 [0,2,0,0,0,0|1,1,0]=4 9273 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Cl 240690a_100020586998_100000178403 [0,2,0,0,0,0|1,1,0]=4 9274 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Cl 527a_100020586998_100000178403 [0,2,0,0,0,0|1,1,0]=4 9275 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000230288_100000755918 [0,2,0,0,0,0|1,1,0]=4 9276 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100000230288 [0,2,0,0,0,0|1,1,0]=4 9277 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)F 1626a_100020586998_100000181075 [0,2,0,0,0,0|1,1,0]=4 9278 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)F 240690a_100020586998_100000181075 [0,2,0,0,0,0|1,1,0]=4 9279 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)F 527a_100020586998_100000181075 [0,2,0,0,0,0|1,1,0]=4 9280 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100000230288 [0,2,0,0,0,0|1,1,0]=4 9281 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)F 62a_100000230288_100000211213 [0,2,0,0,0,0|1,1,0]=4 9282 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100000230288 [0,2,0,0,0,0|1,1,0]=4 9283 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)N 62a_100000230288_100000185761 [0,2,0,0,0,0|1,1,0]=4 9284 B16R1.658 C=CCNC(=O)C(C)Sc1ccc(cc1)O 62a_100000230288_100000185759 [0,2,0,0,0,0|1,1,0]=4 9285 B16R1.658 C=CCNC(=O)C(O)Cc1ccc(cc1)Cl 240690a_100020586998_100012362158 [0,2,0,0,0,0|2,0,0]=4 9286 B16R1.658 C=CCNC(=O)C(O)Cc1ccc(cc1)F 240690a_100020586998_100012179405 [0,2,0,0,0,0|2,0,0]=4 9287 B16R1.658 C=CCNC(=O)C(O)Cc1ccc(cc1)O 240690a_100020586998_100015278814 [0,2,0,0,0,0|2,0,0]=4 9288 B16R1.658 C=CCNC(=O)[C@@H](C)Oc1ccc(cc1)O 240690a_100020586998_100000005562 [0,2,0,0,0,0|1,0,0]=3 9289 B16R1.658 C=CCNC(=O)[C@@H](C)Oc1ccc(cc1)O 527a_100020586998_100000005562 [0,2,0,0,0,0|1,0,0]=3 9290 B16R1.658 C=CCNC(=O)[C@@H](O)Cc1ccc(cc1)Br 240690a_100020586998_200015644258 [0,2,0,0,0,0|2,0,0]=4 9291 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)Br 34a_100000185759_100000760410 [0,2,0,0,0,0|0,0,2]=4 9292 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000760410 [0,2,0,0,0,0|0,0,2]=4 9293 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)C 34a_100000210336_100000760410 [0,2,0,0,0,0|0,0,2]=4 9294 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000760410 [0,2,0,0,0,0|0,0,2]=4 9295 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)Cl 34a_100000210216_100000760410 [0,2,0,0,0,0|0,0,2]=4 9296 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000760410 [0,2,0,0,0,0|0,0,2]=4 9297 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)F 34a_100000210339_100000760410 [0,2,0,0,0,0|0,0,2]=4 9298 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)I 34a_100000212066_100000760410 [0,2,0,0,0,0|0,0,2]=4 9299 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000760410 [0,2,0,0,0,0|0,0,2]=4 9300 B16R1.658 CCCOC(=O)C(C)Oc1ccc(cc1)N 34a_100000185829_100000760410 [0,2,0,0,0,0|0,0,2]=4 9301 B16R1.850 C=CC(C)CC(=O)CCc1ccc(cc1)Br 1458a_100011934298_100011740612 [0,2,0,0,0,0|2,0,0]=4 9302 B16R1.850 C=CC(C)CC(=O)CCc1ccc(cc1)C 1458a_100011934298_100011713686 [0,2,0,0,0,0|2,0,0]=4 9303 B16R1.850 C=CC(C)CC(=O)CCc1ccc(cc1)Cl 1458a_100011934298_100011713675 [0,2,0,0,0,0|2,0,0]=4 9304 B16R1.850 C=CC(C)CC(=O)CCc1ccc(cc1)F 1458a_100011934298_100011217392 [0,2,0,0,0,0|2,0,0]=4 9305 B16R1.850 C=CC(C)CC(=O)CCc1ccc(cc1)O 1458a_100011934298_100009816426 [0,2,0,0,0,0|2,0,0]=4 9306 B16R1.979 C=CCC(C)C(=O)CCc1ccc(cc1)Br 1458a_100011216819_100011740612 [0,2,0,0,0,0|2,0,0]=4 9307 B16R1.979 C=CCC(C)C(=O)CCc1ccc(cc1)C 1458a_100011216819_100011713686 [0,2,0,0,0,0|2,0,0]=4 9308 B16R1.979 C=CCC(C)C(=O)CCc1ccc(cc1)Cl 1458a_100011216819_100011713675 [0,2,0,0,0,0|2,0,0]=4 9309 B16R1.979 C=CCC(C)C(=O)CCc1ccc(cc1)F 1458a_100011216819_100011217392 [0,2,0,0,0,0|2,0,0]=4 9310 B16R1.979 C=CCC(C)C(=O)CCc1ccc(cc1)O 1458a_100011216819_100009816426 [0,2,0,0,0,0|2,0,0]=4 9311 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Br 11a_100000225617_100000217147 [0,2,0,0,0,0|2,0,0]=4 9312 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Br 1626a_100000225617_100000217147 [0,2,0,0,0,0|2,0,0]=4 9313 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Br 240690a_100000225617_100000217147 [0,2,0,0,0,0|2,0,0]=4 9314 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Br 527a_100000225617_100000217147 [0,2,0,0,0,0|2,0,0]=4 9315 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)C 11a_100000225617_100000234883 [0,2,0,0,0,0|2,0,0]=4 9316 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)C 1626a_100000225617_100000234883 [0,2,0,0,0,0|2,0,0]=4 9317 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)C 240690a_100000225617_100000234883 [0,2,0,0,0,0|2,0,0]=4 9318 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)C 527a_100000225617_100000234883 [0,2,0,0,0,0|2,0,0]=4 9319 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Cl 11a_100000225617_100000235379 [0,2,0,0,0,0|2,0,0]=4 9320 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Cl 1626a_100000225617_100000235379 [0,2,0,0,0,0|2,0,0]=4 9321 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Cl 240690a_100000225617_100000235379 [0,2,0,0,0,0|2,0,0]=4 9322 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)Cl 527a_100000225617_100000235379 [0,2,0,0,0,0|2,0,0]=4 9323 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)F 11a_100000225617_100000198493 [0,2,0,0,0,0|2,0,0]=4 9324 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)F 1626a_100000225617_100000198493 [0,2,0,0,0,0|2,0,0]=4 9325 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)F 240690a_100000225617_100000198493 [0,2,0,0,0,0|2,0,0]=4 9326 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)F 527a_100000225617_100000198493 [0,2,0,0,0,0|2,0,0]=4 9327 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)I 11a_100000225617_100011217499 [0,2,0,0,0,0|2,0,0]=4 9328 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)I 1626a_100000225617_100011217499 [0,2,0,0,0,0|2,0,0]=4 9329 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)I 240690a_100000225617_100011217499 [0,2,0,0,0,0|2,0,0]=4 9330 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)I 527a_100000225617_100011217499 [0,2,0,0,0,0|2,0,0]=4 9331 B16R1.979 C=CCN(C)C(=O)CCc1ccc(cc1)O 240690a_100000225617_100000742835 [0,2,0,0,0,0|2,0,0]=4 9332 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Br 11a_100000225617_100000182358 [0,2,0,0,0,0|1,0,0]=3 9333 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Br 1626a_100000225617_100000182358 [0,2,0,0,0,0|1,0,0]=3 9334 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Br 240690a_100000225617_100000182358 [0,2,0,0,0,0|1,0,0]=3 9335 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Br 527a_100000225617_100000182358 [0,2,0,0,0,0|1,0,0]=3 9336 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)C 11a_100000225617_100000182360 [0,2,0,0,0,0|1,0,0]=3 9337 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)C 1626a_100000225617_100000182360 [0,2,0,0,0,0|1,0,0]=3 9338 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)C 240690a_100000225617_100000182360 [0,2,0,0,0,0|1,0,0]=3 9339 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)C 527a_100000225617_100000182360 [0,2,0,0,0,0|1,0,0]=3 9340 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Cl 11a_100000225617_100016990877 [0,2,0,0,0,0|1,0,0]=3 9341 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Cl 1626a_100000225617_100016990877 [0,2,0,0,0,0|1,0,0]=3 9342 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Cl 240690a_100000225617_100016990877 [0,2,0,0,0,0|1,0,0]=3 9343 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)Cl 527a_100000225617_100016990877 [0,2,0,0,0,0|1,0,0]=3 9344 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)F 11a_100000225617_100000184765 [0,2,0,0,0,0|1,0,0]=3 9345 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)F 1626a_100000225617_100000184765 [0,2,0,0,0,0|1,0,0]=3 9346 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)F 240690a_100000225617_100000184765 [0,2,0,0,0,0|1,0,0]=3 9347 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)F 527a_100000225617_100000184765 [0,2,0,0,0,0|1,0,0]=3 9348 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)I 11a_100000225617_100000184369 [0,2,0,0,0,0|1,0,0]=3 9349 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)I 1626a_100000225617_100000184369 [0,2,0,0,0,0|1,0,0]=3 9350 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)I 240690a_100000225617_100000184369 [0,2,0,0,0,0|1,0,0]=3 9351 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)I 527a_100000225617_100000184369 [0,2,0,0,0,0|1,0,0]=3 9352 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)O 240690a_100000225617_100000031633 [0,2,0,0,0,0|1,0,0]=3 9353 B16R1.979 C=CCN(C)C(=O)COc1ccc(cc1)O 527a_100000225617_100000031633 [0,2,0,0,0,0|1,0,0]=3 9354 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Br 11a_100000225617_100000179496 [0,2,0,0,0,0|1,1,0]=4 9355 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Br 1626a_100000225617_100000179496 [0,2,0,0,0,0|1,1,0]=4 9356 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Br 240690a_100000225617_100000179496 [0,2,0,0,0,0|1,1,0]=4 9357 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Br 527a_100000225617_100000179496 [0,2,0,0,0,0|1,1,0]=4 9358 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)C 11a_100000225617_100000179497 [0,2,0,0,0,0|1,1,0]=4 9359 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)C 1626a_100000225617_100000179497 [0,2,0,0,0,0|1,1,0]=4 9360 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)C 240690a_100000225617_100000179497 [0,2,0,0,0,0|1,1,0]=4 9361 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)C 527a_100000225617_100000179497 [0,2,0,0,0,0|1,1,0]=4 9362 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Cl 11a_100000225617_100000178402 [0,2,0,0,0,0|1,1,0]=4 9363 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Cl 1626a_100000225617_100000178402 [0,2,0,0,0,0|1,1,0]=4 9364 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Cl 240690a_100000225617_100000178402 [0,2,0,0,0,0|1,1,0]=4 9365 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)Cl 527a_100000225617_100000178402 [0,2,0,0,0,0|1,1,0]=4 9366 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)F 11a_100000225617_100000691584 [0,2,0,0,0,0|1,1,0]=4 9367 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)F 1626a_100000225617_100000691584 [0,2,0,0,0,0|1,1,0]=4 9368 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)F 240690a_100000225617_100000691584 [0,2,0,0,0,0|1,1,0]=4 9369 B16R1.979 C=CCN(C)C(=O)CSc1ccc(cc1)F 527a_100000225617_100000691584 [0,2,0,0,0,0|1,1,0]=4 9370 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000730704 [0,2,0,0,0,0|2,0,0]=4 9371 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)Br 1458a_200000688413_100011740612 [0,2,0,0,0,0|2,0,0]=4 9372 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000730704 [0,2,0,0,0,0|2,0,0]=4 9373 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)C 1458a_200000688413_100011713686 [0,2,0,0,0,0|2,0,0]=4 9374 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000730704 [0,2,0,0,0,0|2,0,0]=4 9375 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)Cl 1458a_200000688413_100011713675 [0,2,0,0,0,0|2,0,0]=4 9376 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000730704 [0,2,0,0,0,0|2,0,0]=4 9377 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)F 1458a_200000688413_100011217392 [0,2,0,0,0,0|2,0,0]=4 9378 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000730704 [0,2,0,0,0,0|2,0,0]=4 9379 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000730704 [0,2,0,0,0,0|2,0,0]=4 9380 B16R1.1061 C=C(C)CCC(=O)CCc1ccc(cc1)O 1458a_200000688413_100009816426 [0,2,0,0,0,0|2,0,0]=4 9381 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000730704 [0,2,0,0,0,0|1,0,0]=3 9382 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000730704 [0,2,0,0,0,0|1,0,0]=3 9383 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000730704 [0,2,0,0,0,0|1,0,0]=3 9384 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000730704 [0,2,0,0,0,0|1,0,0]=3 9385 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000730704 [0,2,0,0,0,0|1,0,0]=3 9386 B16R1.1061 C=C(C)CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000730704 [0,2,0,0,0,0|1,0,0]=3 9387 B16R1.1061 C=C(C)CCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000730704 [0,2,0,0,0,0|1,1,0]=4 9388 B16R1.1061 C=C(C)CCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000730704 [0,2,0,0,0,0|1,1,0]=4 9389 B16R1.1061 C=C(C)CCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000730704 [0,2,0,0,0,0|1,1,0]=4 9390 B16R1.1061 C=C(C)CCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000730704 [0,2,0,0,0,0|1,1,0]=4 9391 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Br 11a_100000765925_100000217147 [0,2,0,0,0,0|2,0,0]=4 9392 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Br 1626a_100000765925_100000217147 [0,2,0,0,0,0|2,0,0]=4 9393 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Br 240690a_100000765925_100000217147 [0,2,0,0,0,0|2,0,0]=4 9394 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Br 527a_100000765925_100000217147 [0,2,0,0,0,0|2,0,0]=4 9395 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)C 11a_100000765925_100000234883 [0,2,0,0,0,0|2,0,0]=4 9396 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)C 1626a_100000765925_100000234883 [0,2,0,0,0,0|2,0,0]=4 9397 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)C 240690a_100000765925_100000234883 [0,2,0,0,0,0|2,0,0]=4 9398 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)C 527a_100000765925_100000234883 [0,2,0,0,0,0|2,0,0]=4 9399 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Cl 11a_100000765925_100000235379 [0,2,0,0,0,0|2,0,0]=4 9400 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Cl 1626a_100000765925_100000235379 [0,2,0,0,0,0|2,0,0]=4 9401 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Cl 240690a_100000765925_100000235379 [0,2,0,0,0,0|2,0,0]=4 9402 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)Cl 527a_100000765925_100000235379 [0,2,0,0,0,0|2,0,0]=4 9403 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)F 11a_100000765925_100000198493 [0,2,0,0,0,0|2,0,0]=4 9404 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)F 1626a_100000765925_100000198493 [0,2,0,0,0,0|2,0,0]=4 9405 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)F 240690a_100000765925_100000198493 [0,2,0,0,0,0|2,0,0]=4 9406 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)F 527a_100000765925_100000198493 [0,2,0,0,0,0|2,0,0]=4 9407 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)I 11a_100000765925_100011217499 [0,2,0,0,0,0|2,0,0]=4 9408 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)I 1626a_100000765925_100011217499 [0,2,0,0,0,0|2,0,0]=4 9409 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)I 240690a_100000765925_100011217499 [0,2,0,0,0,0|2,0,0]=4 9410 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)I 527a_100000765925_100011217499 [0,2,0,0,0,0|2,0,0]=4 9411 B16R1.1061 C=C(C)CNC(=O)CCc1ccc(cc1)O 240690a_100000765925_100000742835 [0,2,0,0,0,0|2,0,0]=4 9412 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Br 11a_100000765925_100000182358 [0,2,0,0,0,0|1,0,0]=3 9413 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Br 1626a_100000765925_100000182358 [0,2,0,0,0,0|1,0,0]=3 9414 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Br 240690a_100000765925_100000182358 [0,2,0,0,0,0|1,0,0]=3 9415 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Br 527a_100000765925_100000182358 [0,2,0,0,0,0|1,0,0]=3 9416 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)C 11a_100000765925_100000182360 [0,2,0,0,0,0|1,0,0]=3 9417 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)C 1626a_100000765925_100000182360 [0,2,0,0,0,0|1,0,0]=3 9418 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)C 240690a_100000765925_100000182360 [0,2,0,0,0,0|1,0,0]=3 9419 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)C 527a_100000765925_100000182360 [0,2,0,0,0,0|1,0,0]=3 9420 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Cl 11a_100000765925_100016990877 [0,2,0,0,0,0|1,0,0]=3 9421 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Cl 1626a_100000765925_100016990877 [0,2,0,0,0,0|1,0,0]=3 9422 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Cl 240690a_100000765925_100016990877 [0,2,0,0,0,0|1,0,0]=3 9423 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)Cl 527a_100000765925_100016990877 [0,2,0,0,0,0|1,0,0]=3 9424 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)F 11a_100000765925_100000184765 [0,2,0,0,0,0|1,0,0]=3 9425 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)F 1626a_100000765925_100000184765 [0,2,0,0,0,0|1,0,0]=3 9426 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)F 240690a_100000765925_100000184765 [0,2,0,0,0,0|1,0,0]=3 9427 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)F 527a_100000765925_100000184765 [0,2,0,0,0,0|1,0,0]=3 9428 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)I 11a_100000765925_100000184369 [0,2,0,0,0,0|1,0,0]=3 9429 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)I 1626a_100000765925_100000184369 [0,2,0,0,0,0|1,0,0]=3 9430 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)I 240690a_100000765925_100000184369 [0,2,0,0,0,0|1,0,0]=3 9431 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)I 527a_100000765925_100000184369 [0,2,0,0,0,0|1,0,0]=3 9432 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)O 240690a_100000765925_100000031633 [0,2,0,0,0,0|1,0,0]=3 9433 B16R1.1061 C=C(C)CNC(=O)COc1ccc(cc1)O 527a_100000765925_100000031633 [0,2,0,0,0,0|1,0,0]=3 9434 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Br 11a_100000765925_100000179496 [0,2,0,0,0,0|1,1,0]=4 9435 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Br 1626a_100000765925_100000179496 [0,2,0,0,0,0|1,1,0]=4 9436 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Br 240690a_100000765925_100000179496 [0,2,0,0,0,0|1,1,0]=4 9437 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Br 527a_100000765925_100000179496 [0,2,0,0,0,0|1,1,0]=4 9438 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)C 11a_100000765925_100000179497 [0,2,0,0,0,0|1,1,0]=4 9439 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)C 1626a_100000765925_100000179497 [0,2,0,0,0,0|1,1,0]=4 9440 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)C 240690a_100000765925_100000179497 [0,2,0,0,0,0|1,1,0]=4 9441 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)C 527a_100000765925_100000179497 [0,2,0,0,0,0|1,1,0]=4 9442 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Cl 11a_100000765925_100000178402 [0,2,0,0,0,0|1,1,0]=4 9443 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Cl 1626a_100000765925_100000178402 [0,2,0,0,0,0|1,1,0]=4 9444 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Cl 240690a_100000765925_100000178402 [0,2,0,0,0,0|1,1,0]=4 9445 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)Cl 527a_100000765925_100000178402 [0,2,0,0,0,0|1,1,0]=4 9446 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)F 11a_100000765925_100000691584 [0,2,0,0,0,0|1,1,0]=4 9447 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)F 1626a_100000765925_100000691584 [0,2,0,0,0,0|1,1,0]=4 9448 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)F 240690a_100000765925_100000691584 [0,2,0,0,0,0|1,1,0]=4 9449 B16R1.1061 C=C(C)CNC(=O)CSc1ccc(cc1)F 527a_100000765925_100000691584 [0,2,0,0,0,0|1,1,0]=4 9450 B16R1.1061 C=C(C)COC(C)COc1ccc(cc1)C 34a_100011217472_100000748629 [0,2,0,0,0,0|1,0,1]=4 9451 B16R1.1061 C=C(C)COC(C)COc1ccc(cc1)C 7a_100011217472_100000748629 [0,2,0,0,0,0|1,0,1]=4 9452 B16R1.1061 C=C(F)COC(C)COc1ccc(cc1)C 34a_100011217472_100009893438 [0,2,0,0,0,0|1,0,1]=4 9453 B16R1.1061 C=C(F)COC(C)COc1ccc(cc1)C 7a_100011217472_100000042424 [0,2,0,0,0,0|1,0,1]=4 9454 B16R1.1061 Cc1ccc(cc1)OCC(=O)NCC(=O)N 11a_100000711301_100000182360 [0,2,0,0,0,0|2,0,0]=4 9455 B16R1.1061 Cc1ccc(cc1)OCC(=O)NCC(=O)N 240690a_100000711301_100000182360 [0,2,0,0,0,0|2,0,0]=4 9456 B16R1.1061 Cc1ccc(cc1)OCC(=O)NCC(=O)N 527a_100000711301_100000182360 [0,2,0,0,0,0|2,0,0]=4 9457 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Br 11a_100000711301_100000182358 [0,2,0,0,0,0|2,0,0]=4 9458 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Br 240690a_100000711301_100000182358 [0,2,0,0,0,0|2,0,0]=4 9459 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Br 527a_100000711301_100000182358 [0,2,0,0,0,0|2,0,0]=4 9460 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Cl 11a_100000711301_100016990877 [0,2,0,0,0,0|2,0,0]=4 9461 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Cl 240690a_100000711301_100016990877 [0,2,0,0,0,0|2,0,0]=4 9462 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)Cl 527a_100000711301_100016990877 [0,2,0,0,0,0|2,0,0]=4 9463 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)F 11a_100000711301_100000184765 [0,2,0,0,0,0|2,0,0]=4 9464 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)F 240690a_100000711301_100000184765 [0,2,0,0,0,0|2,0,0]=4 9465 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)F 527a_100000711301_100000184765 [0,2,0,0,0,0|2,0,0]=4 9466 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)I 11a_100000711301_100000184369 [0,2,0,0,0,0|2,0,0]=4 9467 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)I 240690a_100000711301_100000184369 [0,2,0,0,0,0|2,0,0]=4 9468 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)I 527a_100000711301_100000184369 [0,2,0,0,0,0|2,0,0]=4 9469 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)O 240690a_100000711301_100000031633 [0,2,0,0,0,0|2,0,0]=4 9470 B16R1.1061 NC(=O)CNC(=O)COc1ccc(cc1)O 527a_100000711301_100000031633 [0,2,0,0,0,0|2,0,0]=4 9471 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Br)Cl 1458a_100000749702_200012945151 [0,2,0,0,0,0|2,0,0]=4 9472 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Br)F 1458a_100011308366_100000754431 [0,2,0,0,0,0|2,0,0]=4 9473 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1C)C 1458a_100000239910_100000754431 [0,2,0,0,0,0|2,0,0]=4 9474 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1C)F 1458a_100011615716_100000754431 [0,2,0,0,0,0|2,0,0]=4 9475 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Cl)Br 1458a_100012349522_100000754431 [0,2,0,0,0,0|2,0,0]=4 9476 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Cl)Cl 1458a_100000736762_100000754431 [0,2,0,0,0,0|2,0,0]=4 9477 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Cl)Cl 1458a_100000749702_200012161198 [0,2,0,0,0,0|2,0,0]=4 9478 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1Cl)F 1458a_100011308368_100000754431 [0,2,0,0,0,0|2,0,0]=4 9479 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1F)Br 1458a_100000747174_100000754431 [0,2,0,0,0,0|2,0,0]=4 9480 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1F)C 1458a_100000061718_100000754431 [0,2,0,0,0,0|2,0,0]=4 9481 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1F)Cl 1458a_100012351355_100000754431 [0,2,0,0,0,0|2,0,0]=4 9482 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1F)F 1458a_100000691965_100000754431 [0,2,0,0,0,0|2,0,0]=4 9483 B16R1.1478 C=CCCC(=O)CCc1ccc(cc1O)O 1458a_100000041388_100000754431 [0,2,0,0,0,0|2,0,0]=4 9484 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Br)Br 1458a_200000181479_100000754431 [0,2,0,0,0,0|1,0,0]=3 9485 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Br)C 1458a_100000186371_100000754431 [0,2,0,0,0,0|1,0,0]=3 9486 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Br)Cl 1458a_100000184090_100000754431 [0,2,0,0,0,0|1,0,0]=3 9487 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Br)F 1458a_100000184067_100000754431 [0,2,0,0,0,0|1,0,0]=3 9488 B16R1.1478 C=CCCC(=O)COc1ccc(cc1C)C 1458a_200000185146_100000754431 [0,2,0,0,0,0|1,0,0]=3 9489 B16R1.1478 C=CCCC(=O)COc1ccc(cc1C)Cl 1458a_100000182498_100000754431 [0,2,0,0,0,0|1,0,0]=3 9490 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Cl)Br 1458a_100000185252_100000754431 [0,2,0,0,0,0|1,0,0]=3 9491 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Cl)C 1458a_200011725833_100000754431 [0,2,0,0,0,0|1,0,0]=3 9492 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Cl)Cl 1458a_100102647096_100000754431 [0,2,0,0,0,0|1,0,0]=3 9493 B16R1.1478 C=CCCC(=O)COc1ccc(cc1Cl)F 1458a_100000191239_100000754431 [0,2,0,0,0,0|1,0,0]=3 9494 B16R1.1478 C=CCCC(=O)COc1ccc(cc1F)Br 1458a_100000184069_100000754431 [0,2,0,0,0,0|1,0,0]=3 9495 B16R1.1478 C=CCCC(=O)COc1ccc(cc1F)Cl 1458a_100012771990_100000754431 [0,2,0,0,0,0|1,0,0]=3 9496 B16R1.1478 C=CCCC(=O)COc1ccc(cc1F)F 1458a_100000737261_100000754431 [0,2,0,0,0,0|1,0,0]=3 9497 B16R1.1478 C=CCCC(=O)COc1ccc(cc1O)Cl 1458a_100010174420_100000754431 [0,2,0,0,0,0|1,0,0]=3 9498 B16R1.1478 C=CCCC(=O)CSc1ccc(cc1C)Br 1458a_100000679851_100000754431 [0,2,0,0,0,0|1,1,0]=4 9499 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Br)F 1626a_100020586998_100011308366 [0,2,0,0,0,0|2,0,0]=4 9500 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Br)F 240690a_100020586998_100011308366 [0,2,0,0,0,0|2,0,0]=4 9501 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Br)F 527a_100020586998_100011308366 [0,2,0,0,0,0|2,0,0]=4 9502 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)C 1626a_100020586998_100000239910 [0,2,0,0,0,0|2,0,0]=4 9503 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)C 240690a_100020586998_100000239910 [0,2,0,0,0,0|2,0,0]=4 9504 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)C 527a_100020586998_100000239910 [0,2,0,0,0,0|2,0,0]=4 9505 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)F 1626a_100020586998_100011615716 [0,2,0,0,0,0|2,0,0]=4 9506 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)F 240690a_100020586998_100011615716 [0,2,0,0,0,0|2,0,0]=4 9507 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1C)F 527a_100020586998_100011615716 [0,2,0,0,0,0|2,0,0]=4 9508 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Br 1626a_100020586998_100012349522 [0,2,0,0,0,0|2,0,0]=4 9509 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Br 240690a_100020586998_100012349522 [0,2,0,0,0,0|2,0,0]=4 9510 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Br 527a_100020586998_100012349522 [0,2,0,0,0,0|2,0,0]=4 9511 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Cl 1626a_100020586998_100000736762 [0,2,0,0,0,0|2,0,0]=4 9512 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Cl 240690a_100020586998_100000736762 [0,2,0,0,0,0|2,0,0]=4 9513 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)Cl 527a_100020586998_100000736762 [0,2,0,0,0,0|2,0,0]=4 9514 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)F 1626a_100020586998_100011308368 [0,2,0,0,0,0|2,0,0]=4 9515 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)F 240690a_100020586998_100011308368 [0,2,0,0,0,0|2,0,0]=4 9516 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1Cl)F 527a_100020586998_100011308368 [0,2,0,0,0,0|2,0,0]=4 9517 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Br 1626a_100020586998_100000747174 [0,2,0,0,0,0|2,0,0]=4 9518 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Br 240690a_100020586998_100000747174 [0,2,0,0,0,0|2,0,0]=4 9519 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Br 527a_100020586998_100000747174 [0,2,0,0,0,0|2,0,0]=4 9520 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)C 1626a_100020586998_100000061718 [0,2,0,0,0,0|2,0,0]=4 9521 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)C 240690a_100020586998_100000061718 [0,2,0,0,0,0|2,0,0]=4 9522 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)C 527a_100020586998_100000061718 [0,2,0,0,0,0|2,0,0]=4 9523 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Cl 1626a_100020586998_100012351355 [0,2,0,0,0,0|2,0,0]=4 9524 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Cl 240690a_100020586998_100012351355 [0,2,0,0,0,0|2,0,0]=4 9525 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)Cl 527a_100020586998_100012351355 [0,2,0,0,0,0|2,0,0]=4 9526 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)F 1626a_100020586998_100000691965 [0,2,0,0,0,0|2,0,0]=4 9527 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)F 240690a_100020586998_100000691965 [0,2,0,0,0,0|2,0,0]=4 9528 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1F)F 527a_100020586998_100000691965 [0,2,0,0,0,0|2,0,0]=4 9529 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1O)O 240690a_100020586998_100000041388 [0,2,0,0,0,0|2,0,0]=4 9530 B16R1.1478 C=CCNC(=O)CCc1ccc(cc1O)O 527a_100020586998_100000041388 [0,2,0,0,0,0|2,0,0]=4 9531 B16R1.1478 C=CCNC(=O)CNc1ccc(cc1C)Br 7a_100000211769_100000183597 [0,2,0,0,0,0|2,0,0]=4 9532 B16R1.1478 C=CCNC(=O)CNc1ccc(cc1C)C 7a_100000736561_100000183597 [0,2,0,0,0,0|2,0,0]=4 9533 B16R1.1478 C=CCNC(=O)CNc1ccc(cc1C)Cl 7a_100000210418_100000183597 [0,2,0,0,0,0|2,0,0]=4 9534 B16R1.1478 C=CCNC(=O)CNc1ccc(cc1C)F 7a_100000211637_100000183597 [0,2,0,0,0,0|2,0,0]=4 9535 B16R1.1478 C=CCNC(=O)CNc1ccc(cc1C)I 7a_100000184554_100000183597 [0,2,0,0,0,0|2,0,0]=4 9536 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Br 1626a_100020586998_200000181479 [0,2,0,0,0,0|1,0,0]=3 9537 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Br 240690a_100020586998_200000181479 [0,2,0,0,0,0|1,0,0]=3 9538 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Br 527a_100020586998_200000181479 [0,2,0,0,0,0|1,0,0]=3 9539 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Br 7a_100000188717_100000183597 [0,2,0,0,0,0|1,0,0]=3 9540 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)C 1626a_100020586998_100000186371 [0,2,0,0,0,0|1,0,0]=3 9541 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)C 240690a_100020586998_100000186371 [0,2,0,0,0,0|1,0,0]=3 9542 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)C 527a_100020586998_100000186371 [0,2,0,0,0,0|1,0,0]=3 9543 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)C 7a_100000210800_100000183597 [0,2,0,0,0,0|1,0,0]=3 9544 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Cl 1626a_100020586998_100000184090 [0,2,0,0,0,0|1,0,0]=3 9545 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Cl 240690a_100020586998_100000184090 [0,2,0,0,0,0|1,0,0]=3 9546 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Cl 527a_100020586998_100000184090 [0,2,0,0,0,0|1,0,0]=3 9547 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)Cl 7a_100000211998_100000183597 [0,2,0,0,0,0|1,0,0]=3 9548 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)F 1626a_100020586998_100000184067 [0,2,0,0,0,0|1,0,0]=3 9549 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)F 240690a_100020586998_100000184067 [0,2,0,0,0,0|1,0,0]=3 9550 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)F 527a_100020586998_100000184067 [0,2,0,0,0,0|1,0,0]=3 9551 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)F 7a_100000211999_100000183597 [0,2,0,0,0,0|1,0,0]=3 9552 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)I 7a_100012361655_100000183597 [0,2,0,0,0,0|1,0,0]=3 9553 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Br)N 7a_100011534360_100000183597 [0,2,0,0,0,0|1,0,0]=3 9554 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)Br 7a_100000186361_100000183597 [0,2,0,0,0,0|1,0,0]=3 9555 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)C 1626a_100020586998_200000185146 [0,2,0,0,0,0|1,0,0]=3 9556 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)C 240690a_100020586998_200000185146 [0,2,0,0,0,0|1,0,0]=3 9557 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)C 527a_100020586998_200000185146 [0,2,0,0,0,0|1,0,0]=3 9558 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)C 7a_100000211776_100000183597 [0,2,0,0,0,0|1,0,0]=3 9559 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)Cl 1626a_100020586998_100000182498 [0,2,0,0,0,0|1,0,0]=3 9560 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)Cl 240690a_100020586998_100000182498 [0,2,0,0,0,0|1,0,0]=3 9561 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)Cl 527a_100020586998_100000182498 [0,2,0,0,0,0|1,0,0]=3 9562 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)Cl 7a_100000211091_100000183597 [0,2,0,0,0,0|1,0,0]=3 9563 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)F 7a_100000764316_100000183597 [0,2,0,0,0,0|1,0,0]=3 9564 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)I 7a_100011218673_100000183597 [0,2,0,0,0,0|1,0,0]=3 9565 B16R1.1478 C=CCNC(=O)COc1ccc(cc1C)N 7a_100011218179_100000183597 [0,2,0,0,0,0|1,0,0]=3 9566 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Br 1626a_100020586998_100000185252 [0,2,0,0,0,0|1,0,0]=3 9567 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Br 240690a_100020586998_100000185252 [0,2,0,0,0,0|1,0,0]=3 9568 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Br 527a_100020586998_100000185252 [0,2,0,0,0,0|1,0,0]=3 9569 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Br 7a_100000186472_100000183597 [0,2,0,0,0,0|1,0,0]=3 9570 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)C 1626a_100020586998_200011725833 [0,2,0,0,0,0|1,0,0]=3 9571 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)C 240690a_100020586998_200011725833 [0,2,0,0,0,0|1,0,0]=3 9572 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)C 527a_100020586998_200011725833 [0,2,0,0,0,0|1,0,0]=3 9573 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)C 7a_100000749699_100000183597 [0,2,0,0,0,0|1,0,0]=3 9574 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Cl 1626a_100020586998_100102647096 [0,2,0,0,0,0|1,0,0]=3 9575 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Cl 240690a_100020586998_100102647096 [0,2,0,0,0,0|1,0,0]=3 9576 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Cl 527a_100020586998_100102647096 [0,2,0,0,0,0|1,0,0]=3 9577 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)Cl 7a_100015191787_100000183597 [0,2,0,0,0,0|1,0,0]=3 9578 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)F 1626a_100020586998_100000191239 [0,2,0,0,0,0|1,0,0]=3 9579 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)F 240690a_100020586998_100000191239 [0,2,0,0,0,0|1,0,0]=3 9580 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)F 527a_100020586998_100000191239 [0,2,0,0,0,0|1,0,0]=3 9581 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)F 7a_100000212004_100000183597 [0,2,0,0,0,0|1,0,0]=3 9582 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)I 7a_100012360047_100000183597 [0,2,0,0,0,0|1,0,0]=3 9583 B16R1.1478 C=CCNC(=O)COc1ccc(cc1Cl)N 7a_100000744943_100000183597 [0,2,0,0,0,0|1,0,0]=3 9584 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Br 1626a_100020586998_100000184069 [0,2,0,0,0,0|1,0,0]=3 9585 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Br 240690a_100020586998_100000184069 [0,2,0,0,0,0|1,0,0]=3 9586 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Br 527a_100020586998_100000184069 [0,2,0,0,0,0|1,0,0]=3 9587 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Br 7a_100000185481_100000183597 [0,2,0,0,0,0|1,0,0]=3 9588 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)C 7a_100011216688_100000183597 [0,2,0,0,0,0|1,0,0]=3 9589 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Cl 1626a_100020586998_100012771990 [0,2,0,0,0,0|1,0,0]=3 9590 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Cl 240690a_100020586998_100012771990 [0,2,0,0,0,0|1,0,0]=3 9591 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Cl 527a_100020586998_100012771990 [0,2,0,0,0,0|1,0,0]=3 9592 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)Cl 7a_100000230166_100000183597 [0,2,0,0,0,0|1,0,0]=3 9593 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)F 1626a_100020586998_100000737261 [0,2,0,0,0,0|1,0,0]=3 9594 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)F 240690a_100020586998_100000737261 [0,2,0,0,0,0|1,0,0]=3 9595 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)F 527a_100020586998_100000737261 [0,2,0,0,0,0|1,0,0]=3 9596 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)F 7a_100000230127_100000183597 [0,2,0,0,0,0|1,0,0]=3 9597 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)I 7a_100011356965_100000183597 [0,2,0,0,0,0|1,0,0]=3 9598 B16R1.1478 C=CCNC(=O)COc1ccc(cc1F)N 7a_100011220035_100000183597 [0,2,0,0,0,0|1,0,0]=3 9599 B16R1.1478 C=CCNC(=O)COc1ccc(cc1I)Br 7a_100012355227_100000183597 [0,2,0,0,0,0|1,0,0]=3 9600 B16R1.1478 C=CCNC(=O)COc1ccc(cc1I)C 7a_100000765521_100000183597 [0,2,0,0,0,0|1,0,0]=3 9601 B16R1.1478 C=CCNC(=O)COc1ccc(cc1I)Cl 7a_100011356953_100000183597 [0,2,0,0,0,0|1,0,0]=3 9602 B16R1.1478 C=CCNC(=O)COc1ccc(cc1I)F 7a_100012355409_100000183597 [0,2,0,0,0,0|1,0,0]=3 9603 B16R1.1478 C=CCNC(=O)COc1ccc(cc1I)I 7a_100010001573_100000183597 [0,2,0,0,0,0|1,0,0]=3 9604 B16R1.1478 C=CCNC(=O)COc1ccc(cc1N)Br 7a_100000752626_100000183597 [0,2,0,0,0,0|1,0,0]=3 9605 B16R1.1478 C=CCNC(=O)COc1ccc(cc1N)C 7a_100011215204_100000183597 [0,2,0,0,0,0|1,0,0]=3 9606 B16R1.1478 C=CCNC(=O)COc1ccc(cc1N)Cl 7a_100000210500_100000183597 [0,2,0,0,0,0|1,0,0]=3 9607 B16R1.1478 C=CCNC(=O)COc1ccc(cc1N)F 7a_100000759472_100000183597 [0,2,0,0,0,0|1,0,0]=3 9608 B16R1.1478 C=CCNC(=O)COc1ccc(cc1N)I 7a_100000753495_100000183597 [0,2,0,0,0,0|1,0,0]=3 9609 B16R1.1478 C=CCNC(=O)COc1ccc(cc1O)Cl 240690a_100020586998_100010174420 [0,2,0,0,0,0|1,0,0]=3 9610 B16R1.1478 C=CCNC(=O)COc1ccc(cc1O)Cl 527a_100020586998_100010174420 [0,2,0,0,0,0|1,0,0]=3 9611 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Br)Br 7a_100009999766_100000183597 [0,2,0,0,0,0|2,0,0]=4 9612 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Br)C 7a_100000702858_100000183597 [0,2,0,0,0,0|2,0,0]=4 9613 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Br)Cl 7a_100010219353_100000183597 [0,2,0,0,0,0|2,0,0]=4 9614 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Br)F 7a_100009887730_100000183597 [0,2,0,0,0,0|2,0,0]=4 9615 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Br)I 7a_100000725334_100000183597 [0,2,0,0,0,0|2,0,0]=4 9616 B16R1.1478 C=CCNC(=O)COc1ccc(nc1C)Br 7a_100012002022_100000183597 [0,2,0,0,0,0|2,0,0]=4 9617 B16R1.1478 C=CCNC(=O)COc1ccc(nc1C)C 7a_100011218912_100000183597 [0,2,0,0,0,0|2,0,0]=4 9618 B16R1.1478 C=CCNC(=O)COc1ccc(nc1C)Cl 7a_100012184626_100000183597 [0,2,0,0,0,0|2,0,0]=4 9619 B16R1.1478 C=CCNC(=O)COc1ccc(nc1C)F 7a_100009881036_100000183597 [0,2,0,0,0,0|2,0,0]=4 9620 B16R1.1478 C=CCNC(=O)COc1ccc(nc1C)I 7a_100010233687_100000183597 [0,2,0,0,0,0|2,0,0]=4 9621 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Cl)Br 7a_100010246206_100000183597 [0,2,0,0,0,0|2,0,0]=4 9622 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Cl)C 7a_100000086286_100000183597 [0,2,0,0,0,0|2,0,0]=4 9623 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Cl)Cl 7a_100000101165_100000183597 [0,2,0,0,0,0|2,0,0]=4 9624 B16R1.1478 C=CCNC(=O)COc1ccc(nc1Cl)I 7a_100000721234_100000183597 [0,2,0,0,0,0|2,0,0]=4 9625 B16R1.1478 C=CCNC(=O)COc1ccc(nc1F)Br 7a_100009819667_100000183597 [0,2,0,0,0,0|2,0,0]=4 9626 B16R1.1478 C=CCNC(=O)COc1ccc(nc1F)C 7a_100000079963_100000183597 [0,2,0,0,0,0|2,0,0]=4 9627 B16R1.1478 C=CCNC(=O)COc1ccc(nc1F)Cl 7a_100009880201_100000183597 [0,2,0,0,0,0|2,0,0]=4 9628 B16R1.1478 C=CCNC(=O)COc1ccc(nc1F)F 7a_100000101184_100000183597 [0,2,0,0,0,0|2,0,0]=4 9629 B16R1.1478 C=CCNC(=O)COc1ccc(nc1I)Br 7a_100010253912_100000183597 [0,2,0,0,0,0|2,0,0]=4 9630 B16R1.1478 C=CCNC(=O)COc1ccc(nc1I)C 7a_100000023897_100000183597 [0,2,0,0,0,0|2,0,0]=4 9631 B16R1.1478 C=CCNC(=O)COc1ccc(nc1I)Cl 7a_100000696390_100000183597 [0,2,0,0,0,0|2,0,0]=4 9632 B16R1.1478 C=CCNC(=O)COc1ccc(nc1I)F 7a_100010382442_100000183597 [0,2,0,0,0,0|2,0,0]=4 9633 B16R1.1478 C=CCNC(=O)COc1ccc(nc1N)Br 7a_100000685527_100000183597 [0,2,0,0,0,0|2,0,0]=4 9634 B16R1.1478 C=CCNC(=O)COc1ccc(nc1N)C 7a_100000694039_100000183597 [0,2,0,0,0,0|2,0,0]=4 9635 B16R1.1478 C=CCNC(=O)COc1ccc(nc1N)Cl 7a_100000717809_100000183597 [0,2,0,0,0,0|2,0,0]=4 9636 B16R1.1478 C=CCNC(=O)COc1cnc(cc1Br)C 7a_100009843476_100000183597 [0,2,0,0,0,0|2,0,0]=4 9637 B16R1.1478 C=CCNC(=O)COc1cnc(cc1C)C 7a_200000068632_100000183597 [0,2,0,0,0,0|2,0,0]=4 9638 B16R1.1478 C=CCNC(=O)COc1cnc(cc1C)Cl 7a_100000692680_100000183597 [0,2,0,0,0,0|2,0,0]=4 9639 B16R1.1478 C=CCNC(=O)COc1cnc(cc1C)F 7a_100009856773_100000183597 [0,2,0,0,0,0|2,0,0]=4 9640 B16R1.1478 C=CCNC(=O)COc1cnc(cc1Cl)Cl 7a_100009868576_100000183597 [0,2,0,0,0,0|2,0,0]=4 9641 B16R1.1478 C=CCNC(=O)COc1cnc(cc1F)F 7a_100009885687_100000183597 [0,2,0,0,0,0|2,0,0]=4 9642 B16R1.1478 C=CCNC(=O)COc1cnc(cc1I)Cl 7a_100000698892_100000183597 [0,2,0,0,0,0|2,0,0]=4 9643 B16R1.1478 C=CCNC(=O)COc1cnc(cc1N)Br 7a_100009819941_100000183597 [0,2,0,0,0,0|2,0,0]=4 9644 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)Br 62a_100000183597_100011484698 [0,2,0,0,0,0|1,1,0]=4 9645 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)Br 62a_100011484698_100000183597 [0,2,0,0,0,0|1,1,0]=4 9646 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)C 62a_100000183597_100009813563 [0,2,0,0,0,0|1,1,0]=4 9647 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)C 62a_100009813563_100000183597 [0,2,0,0,0,0|1,1,0]=4 9648 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)Cl 62a_100000183597_100011219703 [0,2,0,0,0,0|1,1,0]=4 9649 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)Cl 62a_100011219703_100000183597 [0,2,0,0,0,0|1,1,0]=4 9650 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)F 62a_100000183597_100011217111 [0,2,0,0,0,0|1,1,0]=4 9651 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)F 62a_100011217111_100000183597 [0,2,0,0,0,0|1,1,0]=4 9652 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)N 62a_100000183597_100000750458 [0,2,0,0,0,0|1,1,0]=4 9653 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)N 62a_100000750458_100000183597 [0,2,0,0,0,0|1,1,0]=4 9654 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)O 62a_100000183597_100000701344 [0,2,0,0,0,0|1,1,0]=4 9655 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Br)O 62a_100000701344_100000183597 [0,2,0,0,0,0|1,1,0]=4 9656 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Br 240690a_100020586998_100000679851 [0,2,0,0,0,0|1,1,0]=4 9657 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Br 527a_100020586998_100000679851 [0,2,0,0,0,0|1,1,0]=4 9658 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Br 62a_100000183597_100000701812 [0,2,0,0,0,0|1,1,0]=4 9659 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Br 62a_100000701812_100000183597 [0,2,0,0,0,0|1,1,0]=4 9660 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)C 62a_100000183597_100011217332 [0,2,0,0,0,0|1,1,0]=4 9661 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)C 62a_100011217332_100000183597 [0,2,0,0,0,0|1,1,0]=4 9662 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Cl 62a_100000183597_100011219607 [0,2,0,0,0,0|1,1,0]=4 9663 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)Cl 62a_100011219607_100000183597 [0,2,0,0,0,0|1,1,0]=4 9664 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)F 62a_100000183597_100011205405 [0,2,0,0,0,0|1,1,0]=4 9665 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)F 62a_100011205405_100000183597 [0,2,0,0,0,0|1,1,0]=4 9666 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)N 62a_100000183597_100000210723 [0,2,0,0,0,0|1,1,0]=4 9667 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)N 62a_100000210723_100000183597 [0,2,0,0,0,0|1,1,0]=4 9668 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1C)O 62a_100000183597_100000690111 [0,2,0,0,0,0|1,1,0]=4 9669 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)Br 62a_100000183597_100011216062 [0,2,0,0,0,0|1,1,0]=4 9670 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)Br 62a_100011216062_100000183597 [0,2,0,0,0,0|1,1,0]=4 9671 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)C 62a_100000183597_100011263221 [0,2,0,0,0,0|1,1,0]=4 9672 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)C 62a_100011263221_100000183597 [0,2,0,0,0,0|1,1,0]=4 9673 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)Cl 62a_100000183597_100000699841 [0,2,0,0,0,0|1,1,0]=4 9674 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)Cl 62a_100000699841_100000183597 [0,2,0,0,0,0|1,1,0]=4 9675 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)F 62a_100000183597_100000733362 [0,2,0,0,0,0|1,1,0]=4 9676 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)F 62a_100000733362_100000183597 [0,2,0,0,0,0|1,1,0]=4 9677 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)N 62a_100000183597_100000761885 [0,2,0,0,0,0|1,1,0]=4 9678 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)N 62a_100000761885_100000183597 [0,2,0,0,0,0|1,1,0]=4 9679 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)O 62a_100000047559_100000183597 [0,2,0,0,0,0|1,1,0]=4 9680 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1Cl)O 62a_100000183597_100000047559 [0,2,0,0,0,0|1,1,0]=4 9681 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)Br 62a_100000183597_100009814013 [0,2,0,0,0,0|1,1,0]=4 9682 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)Br 62a_100009814013_100000183597 [0,2,0,0,0,0|1,1,0]=4 9683 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)C 62a_100000183597_100011216119 [0,2,0,0,0,0|1,1,0]=4 9684 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)C 62a_100011216119_100000183597 [0,2,0,0,0,0|1,1,0]=4 9685 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)Cl 62a_100000183597_100011216042 [0,2,0,0,0,0|1,1,0]=4 9686 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)Cl 62a_100011216042_100000183597 [0,2,0,0,0,0|1,1,0]=4 9687 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)F 62a_100000183597_100000750030 [0,2,0,0,0,0|1,1,0]=4 9688 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)F 62a_100000750030_100000183597 [0,2,0,0,0,0|1,1,0]=4 9689 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)N 62a_100000183597_100011356925 [0,2,0,0,0,0|1,1,0]=4 9690 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)N 62a_100011356925_100000183597 [0,2,0,0,0,0|1,1,0]=4 9691 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)O 62a_100000183597_100000755031 [0,2,0,0,0,0|1,1,0]=4 9692 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1F)O 62a_100000755031_100000183597 [0,2,0,0,0,0|1,1,0]=4 9693 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)Br 62a_100000183597_100000743836 [0,2,0,0,0,0|1,1,0]=4 9694 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)Br 62a_100000743836_100000183597 [0,2,0,0,0,0|1,1,0]=4 9695 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)C 62a_100000183597_100011216686 [0,2,0,0,0,0|1,1,0]=4 9696 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)C 62a_100011216686_100000183597 [0,2,0,0,0,0|1,1,0]=4 9697 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)Cl 62a_100000183597_100000761886 [0,2,0,0,0,0|1,1,0]=4 9698 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)Cl 62a_100000761886_100000183597 [0,2,0,0,0,0|1,1,0]=4 9699 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)F 62a_100000183597_100000687223 [0,2,0,0,0,0|1,1,0]=4 9700 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)F 62a_100000687223_100000183597 [0,2,0,0,0,0|1,1,0]=4 9701 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)N 62a_100000183597_200012175722 [0,2,0,0,0,0|1,1,0]=4 9702 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)N 62a_200012175722_100000183597 [0,2,0,0,0,0|1,1,0]=4 9703 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)O 62a_100000183597_100011999798 [0,2,0,0,0,0|1,1,0]=4 9704 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1N)O 62a_100011999798_100000183597 [0,2,0,0,0,0|1,1,0]=4 9705 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)Br 62a_100000183597_100012344904 [0,2,0,0,0,0|1,1,0]=4 9706 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)Br 62a_100012344904_100000183597 [0,2,0,0,0,0|1,1,0]=4 9707 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)C 62a_100000183597_100012002257 [0,2,0,0,0,0|1,1,0]=4 9708 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)C 62a_100012002257_100000183597 [0,2,0,0,0,0|1,1,0]=4 9709 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)Cl 62a_100000050036_100000183597 [0,2,0,0,0,0|1,1,0]=4 9710 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)Cl 62a_100000183597_100000050036 [0,2,0,0,0,0|1,1,0]=4 9711 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)F 62a_100000183597_100000690578 [0,2,0,0,0,0|1,1,0]=4 9712 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)F 62a_100000690578_100000183597 [0,2,0,0,0,0|1,1,0]=4 9713 B16R1.1478 C=CCNC(=O)CSc1ccc(cc1O)O 62a_100000183597_100009813921 [0,2,0,0,0,0|1,1,0]=4 9714 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Br)Br 34a_100000211012_100000033060 [0,2,0,0,0,0|1,0,0]=3 9715 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Br)C 34a_100000210942_100000033060 [0,2,0,0,0,0|1,0,0]=3 9716 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Br)Cl 34a_100000752454_100000033060 [0,2,0,0,0,0|1,0,0]=3 9717 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Br)F 34a_100000738039_100000033060 [0,2,0,0,0,0|1,0,0]=3 9718 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Br)O 34a_100012001276_100000033060 [0,2,0,0,0,0|1,0,0]=3 9719 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)Br 34a_100000211769_100000033060 [0,2,0,0,0,0|1,0,0]=3 9720 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)Br 7a_100000211769_100000033060 [0,2,0,0,0,0|1,0,0]=3 9721 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)C 34a_100000736561_100000033060 [0,2,0,0,0,0|1,0,0]=3 9722 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)C 7a_100000736561_100000033060 [0,2,0,0,0,0|1,0,0]=3 9723 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)Cl 34a_100000210418_100000033060 [0,2,0,0,0,0|1,0,0]=3 9724 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)Cl 7a_100000210418_100000033060 [0,2,0,0,0,0|1,0,0]=3 9725 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)F 34a_100000211637_100000033060 [0,2,0,0,0,0|1,0,0]=3 9726 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)F 7a_100000211637_100000033060 [0,2,0,0,0,0|1,0,0]=3 9727 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)I 34a_100000184554_100000033060 [0,2,0,0,0,0|1,0,0]=3 9728 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)I 7a_100000184554_100000033060 [0,2,0,0,0,0|1,0,0]=3 9729 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1C)O 34a_100000756630_100000033060 [0,2,0,0,0,0|1,0,0]=3 9730 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)Br 34a_100000211467_100000033060 [0,2,0,0,0,0|1,0,0]=3 9731 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)C 34a_100000210522_100000033060 [0,2,0,0,0,0|1,0,0]=3 9732 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)Cl 34a_100000185861_100000033060 [0,2,0,0,0,0|1,0,0]=3 9733 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)F 34a_100000212003_100000033060 [0,2,0,0,0,0|1,0,0]=3 9734 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)I 34a_100011218065_100000033060 [0,2,0,0,0,0|1,0,0]=3 9735 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1Cl)O 34a_100011215599_100000033060 [0,2,0,0,0,0|1,0,0]=3 9736 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)Br 34a_100000210722_100000033060 [0,2,0,0,0,0|1,0,0]=3 9737 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)C 34a_100000211023_100000033060 [0,2,0,0,0,0|1,0,0]=3 9738 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)Cl 34a_100000211020_100000033060 [0,2,0,0,0,0|1,0,0]=3 9739 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)F 34a_100000210720_100000033060 [0,2,0,0,0,0|1,0,0]=3 9740 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)I 34a_100011215594_100000033060 [0,2,0,0,0,0|1,0,0]=3 9741 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1F)O 34a_100000759473_100000033060 [0,2,0,0,0,0|1,0,0]=3 9742 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1I)Br 34a_100000187925_100000033060 [0,2,0,0,0,0|1,0,0]=3 9743 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1I)C 34a_100011356834_100000033060 [0,2,0,0,0,0|1,0,0]=3 9744 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1I)Cl 34a_100000761889_100000033060 [0,2,0,0,0,0|1,0,0]=3 9745 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1I)F 34a_100000760547_100000033060 [0,2,0,0,0,0|1,0,0]=3 9746 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1I)O 34a_100010084370_100000033060 [0,2,0,0,0,0|1,0,0]=3 9747 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1O)Br 34a_100000739049_100000033060 [0,2,0,0,0,0|1,0,0]=3 9748 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1O)C 34a_100000211527_100000033060 [0,2,0,0,0,0|1,0,0]=3 9749 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1O)Cl 34a_100000185728_100000033060 [0,2,0,0,0,0|1,0,0]=3 9750 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1O)F 34a_100000753323_100000033060 [0,2,0,0,0,0|1,0,0]=3 9751 B16R1.1478 C=CCOC(=O)CNc1ccc(cc1O)O 34a_100000106777_100000033060 [0,2,0,0,0,0|1,0,0]=3 9752 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)Br 34a_100000188717_100000033060 [0,2,0,0,0,0|0,0,0]=2 9753 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)Br 7a_100000188717_100000033060 [0,2,0,0,0,0|0,0,0]=2 9754 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)C 34a_100000210800_100000033060 [0,2,0,0,0,0|0,0,0]=2 9755 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)C 7a_100000210800_100000033060 [0,2,0,0,0,0|0,0,0]=2 9756 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)Cl 34a_100000211998_100000033060 [0,2,0,0,0,0|0,0,0]=2 9757 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)Cl 7a_100000211998_100000033060 [0,2,0,0,0,0|0,0,0]=2 9758 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)F 34a_100000211999_100000033060 [0,2,0,0,0,0|0,0,0]=2 9759 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)F 7a_100000211999_100000033060 [0,2,0,0,0,0|0,0,0]=2 9760 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)I 34a_100012361655_100000033060 [0,2,0,0,0,0|0,0,0]=2 9761 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)I 7a_100012361655_100000033060 [0,2,0,0,0,0|0,0,0]=2 9762 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)N 34a_100011534360_100000033060 [0,2,0,0,0,0|0,0,0]=2 9763 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Br)N 7a_100011534360_100000033060 [0,2,0,0,0,0|0,0,0]=2 9764 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)Br 34a_100000186361_100000033060 [0,2,0,0,0,0|0,0,0]=2 9765 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)Br 7a_100000186361_100000033060 [0,2,0,0,0,0|0,0,0]=2 9766 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)C 34a_100000211776_100000033060 [0,2,0,0,0,0|0,0,0]=2 9767 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)C 7a_100000211776_100000033060 [0,2,0,0,0,0|0,0,0]=2 9768 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)Cl 34a_100000211091_100000033060 [0,2,0,0,0,0|0,0,0]=2 9769 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)Cl 7a_100000211091_100000033060 [0,2,0,0,0,0|0,0,0]=2 9770 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)F 34a_100000764316_100000033060 [0,2,0,0,0,0|0,0,0]=2 9771 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)F 7a_100000764316_100000033060 [0,2,0,0,0,0|0,0,0]=2 9772 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)I 34a_100011218673_100000033060 [0,2,0,0,0,0|0,0,0]=2 9773 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)I 7a_100011218673_100000033060 [0,2,0,0,0,0|0,0,0]=2 9774 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)N 34a_100011218179_100000033060 [0,2,0,0,0,0|0,0,0]=2 9775 B16R1.1478 C=CCOC(=O)COc1ccc(cc1C)N 7a_100011218179_100000033060 [0,2,0,0,0,0|0,0,0]=2 9776 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)Br 34a_100000186472_100000033060 [0,2,0,0,0,0|0,0,0]=2 9777 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)Br 7a_100000186472_100000033060 [0,2,0,0,0,0|0,0,0]=2 9778 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)C 34a_100000749699_100000033060 [0,2,0,0,0,0|0,0,0]=2 9779 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)C 7a_100000749699_100000033060 [0,2,0,0,0,0|0,0,0]=2 9780 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)Cl 34a_100015191787_100000033060 [0,2,0,0,0,0|0,0,0]=2 9781 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)Cl 7a_100015191787_100000033060 [0,2,0,0,0,0|0,0,0]=2 9782 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)F 34a_100000212004_100000033060 [0,2,0,0,0,0|0,0,0]=2 9783 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)F 7a_100000212004_100000033060 [0,2,0,0,0,0|0,0,0]=2 9784 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)I 34a_100012360047_100000033060 [0,2,0,0,0,0|0,0,0]=2 9785 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)I 7a_100012360047_100000033060 [0,2,0,0,0,0|0,0,0]=2 9786 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)N 34a_100000744943_100000033060 [0,2,0,0,0,0|0,0,0]=2 9787 B16R1.1478 C=CCOC(=O)COc1ccc(cc1Cl)N 7a_100000744943_100000033060 [0,2,0,0,0,0|0,0,0]=2 9788 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)Br 34a_100000185481_100000033060 [0,2,0,0,0,0|0,0,0]=2 9789 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)Br 7a_100000185481_100000033060 [0,2,0,0,0,0|0,0,0]=2 9790 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)C 34a_100011216688_100000033060 [0,2,0,0,0,0|0,0,0]=2 9791 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)C 7a_100011216688_100000033060 [0,2,0,0,0,0|0,0,0]=2 9792 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)Cl 34a_100000230166_100000033060 [0,2,0,0,0,0|0,0,0]=2 9793 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)Cl 7a_100000230166_100000033060 [0,2,0,0,0,0|0,0,0]=2 9794 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)F 34a_100000230127_100000033060 [0,2,0,0,0,0|0,0,0]=2 9795 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)F 7a_100000230127_100000033060 [0,2,0,0,0,0|0,0,0]=2 9796 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)I 34a_100011356965_100000033060 [0,2,0,0,0,0|0,0,0]=2 9797 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)I 7a_100011356965_100000033060 [0,2,0,0,0,0|0,0,0]=2 9798 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)N 34a_100011220035_100000033060 [0,2,0,0,0,0|0,0,0]=2 9799 B16R1.1478 C=CCOC(=O)COc1ccc(cc1F)N 7a_100011220035_100000033060 [0,2,0,0,0,0|0,0,0]=2 9800 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)Br 34a_100012355227_100000033060 [0,2,0,0,0,0|0,0,0]=2 9801 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)Br 7a_100012355227_100000033060 [0,2,0,0,0,0|0,0,0]=2 9802 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)C 34a_100000765521_100000033060 [0,2,0,0,0,0|0,0,0]=2 9803 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)C 7a_100000765521_100000033060 [0,2,0,0,0,0|0,0,0]=2 9804 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)Cl 34a_100011356953_100000033060 [0,2,0,0,0,0|0,0,0]=2 9805 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)Cl 7a_100011356953_100000033060 [0,2,0,0,0,0|0,0,0]=2 9806 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)F 34a_100012355409_100000033060 [0,2,0,0,0,0|0,0,0]=2 9807 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)F 7a_100012355409_100000033060 [0,2,0,0,0,0|0,0,0]=2 9808 B16R1.1478 C=CCOC(=O)COc1ccc(cc1I)I 7a_100010001573_100000033060 [0,2,0,0,0,0|0,0,0]=2 9809 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)Br 34a_100000752626_100000033060 [0,2,0,0,0,0|0,0,0]=2 9810 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)Br 7a_100000752626_100000033060 [0,2,0,0,0,0|0,0,0]=2 9811 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)C 34a_100011215204_100000033060 [0,2,0,0,0,0|0,0,0]=2 9812 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)C 7a_100011215204_100000033060 [0,2,0,0,0,0|0,0,0]=2 9813 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)Cl 34a_100000210500_100000033060 [0,2,0,0,0,0|0,0,0]=2 9814 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)Cl 7a_100000210500_100000033060 [0,2,0,0,0,0|0,0,0]=2 9815 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)F 34a_100000759472_100000033060 [0,2,0,0,0,0|0,0,0]=2 9816 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)F 7a_100000759472_100000033060 [0,2,0,0,0,0|0,0,0]=2 9817 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)I 34a_100000753495_100000033060 [0,2,0,0,0,0|0,0,0]=2 9818 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)I 7a_100000753495_100000033060 [0,2,0,0,0,0|0,0,0]=2 9819 B16R1.1478 C=CCOC(=O)COc1ccc(cc1N)N 34a_100000725306_100000033060 [0,2,0,0,0,0|0,0,0]=2 9820 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)Br 34a_100009999766_100000033060 [0,2,0,0,0,0|1,0,0]=3 9821 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)Br 7a_100009999766_100000033060 [0,2,0,0,0,0|1,0,0]=3 9822 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)C 34a_100000702858_100000033060 [0,2,0,0,0,0|1,0,0]=3 9823 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)C 7a_100000702858_100000033060 [0,2,0,0,0,0|1,0,0]=3 9824 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)Cl 34a_100010219353_100000033060 [0,2,0,0,0,0|1,0,0]=3 9825 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)Cl 7a_100010219353_100000033060 [0,2,0,0,0,0|1,0,0]=3 9826 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)F 34a_100009887730_100000033060 [0,2,0,0,0,0|1,0,0]=3 9827 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)F 7a_100009887730_100000033060 [0,2,0,0,0,0|1,0,0]=3 9828 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)I 34a_100000725334_100000033060 [0,2,0,0,0,0|1,0,0]=3 9829 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Br)I 7a_100000725334_100000033060 [0,2,0,0,0,0|1,0,0]=3 9830 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)Br 34a_100012002022_100000033060 [0,2,0,0,0,0|1,0,0]=3 9831 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)Br 7a_100012002022_100000033060 [0,2,0,0,0,0|1,0,0]=3 9832 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)C 34a_100011218912_100000033060 [0,2,0,0,0,0|1,0,0]=3 9833 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)C 7a_100011218912_100000033060 [0,2,0,0,0,0|1,0,0]=3 9834 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)Cl 34a_100012184626_100000033060 [0,2,0,0,0,0|1,0,0]=3 9835 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)Cl 7a_100012184626_100000033060 [0,2,0,0,0,0|1,0,0]=3 9836 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)F 34a_100009881036_100000033060 [0,2,0,0,0,0|1,0,0]=3 9837 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)F 7a_100009881036_100000033060 [0,2,0,0,0,0|1,0,0]=3 9838 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)I 34a_100010233687_100000033060 [0,2,0,0,0,0|1,0,0]=3 9839 B16R1.1478 C=CCOC(=O)COc1ccc(nc1C)I 7a_100010233687_100000033060 [0,2,0,0,0,0|1,0,0]=3 9840 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)Br 34a_100010246206_100000033060 [0,2,0,0,0,0|1,0,0]=3 9841 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)Br 7a_100010246206_100000033060 [0,2,0,0,0,0|1,0,0]=3 9842 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)C 34a_100000086286_100000033060 [0,2,0,0,0,0|1,0,0]=3 9843 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)C 7a_100000086286_100000033060 [0,2,0,0,0,0|1,0,0]=3 9844 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)Cl 34a_100000101165_100000033060 [0,2,0,0,0,0|1,0,0]=3 9845 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)Cl 7a_100000101165_100000033060 [0,2,0,0,0,0|1,0,0]=3 9846 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)I 34a_100000721234_100000033060 [0,2,0,0,0,0|1,0,0]=3 9847 B16R1.1478 C=CCOC(=O)COc1ccc(nc1Cl)I 7a_100000721234_100000033060 [0,2,0,0,0,0|1,0,0]=3 9848 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)Br 34a_100009819667_100000033060 [0,2,0,0,0,0|1,0,0]=3 9849 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)Br 7a_100009819667_100000033060 [0,2,0,0,0,0|1,0,0]=3 9850 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)C 34a_100000079963_100000033060 [0,2,0,0,0,0|1,0,0]=3 9851 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)C 7a_100000079963_100000033060 [0,2,0,0,0,0|1,0,0]=3 9852 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)Cl 34a_100009880201_100000033060 [0,2,0,0,0,0|1,0,0]=3 9853 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)Cl 7a_100009880201_100000033060 [0,2,0,0,0,0|1,0,0]=3 9854 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)F 34a_100000101184_100000033060 [0,2,0,0,0,0|1,0,0]=3 9855 B16R1.1478 C=CCOC(=O)COc1ccc(nc1F)F 7a_100000101184_100000033060 [0,2,0,0,0,0|1,0,0]=3 9856 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)Br 34a_100010253912_100000033060 [0,2,0,0,0,0|1,0,0]=3 9857 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)Br 7a_100010253912_100000033060 [0,2,0,0,0,0|1,0,0]=3 9858 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)C 34a_100000023897_100000033060 [0,2,0,0,0,0|1,0,0]=3 9859 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)C 7a_100000023897_100000033060 [0,2,0,0,0,0|1,0,0]=3 9860 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)Cl 34a_100000696390_100000033060 [0,2,0,0,0,0|1,0,0]=3 9861 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)Cl 7a_100000696390_100000033060 [0,2,0,0,0,0|1,0,0]=3 9862 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)F 34a_100010382442_100000033060 [0,2,0,0,0,0|1,0,0]=3 9863 B16R1.1478 C=CCOC(=O)COc1ccc(nc1I)F 7a_100010382442_100000033060 [0,2,0,0,0,0|1,0,0]=3 9864 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)Br 34a_100000685527_100000033060 [0,2,0,0,0,0|1,0,0]=3 9865 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)Br 7a_100000685527_100000033060 [0,2,0,0,0,0|1,0,0]=3 9866 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)C 34a_100000694039_100000033060 [0,2,0,0,0,0|1,0,0]=3 9867 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)C 7a_100000694039_100000033060 [0,2,0,0,0,0|1,0,0]=3 9868 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)Cl 34a_100000717809_100000033060 [0,2,0,0,0,0|1,0,0]=3 9869 B16R1.1478 C=CCOC(=O)COc1ccc(nc1N)Cl 7a_100000717809_100000033060 [0,2,0,0,0,0|1,0,0]=3 9870 B16R1.1478 C=CCOC(=O)COc1cnc(cc1Br)C 34a_100009843476_100000033060 [0,2,0,0,0,0|1,0,0]=3 9871 B16R1.1478 C=CCOC(=O)COc1cnc(cc1Br)C 7a_100009843476_100000033060 [0,2,0,0,0,0|1,0,0]=3 9872 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)C 34a_200000068632_100000033060 [0,2,0,0,0,0|1,0,0]=3 9873 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)C 7a_200000068632_100000033060 [0,2,0,0,0,0|1,0,0]=3 9874 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)Cl 34a_100000692680_100000033060 [0,2,0,0,0,0|1,0,0]=3 9875 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)Cl 7a_100000692680_100000033060 [0,2,0,0,0,0|1,0,0]=3 9876 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)F 34a_100009856773_100000033060 [0,2,0,0,0,0|1,0,0]=3 9877 B16R1.1478 C=CCOC(=O)COc1cnc(cc1C)F 7a_100009856773_100000033060 [0,2,0,0,0,0|1,0,0]=3 9878 B16R1.1478 C=CCOC(=O)COc1cnc(cc1Cl)Cl 34a_100009868576_100000033060 [0,2,0,0,0,0|1,0,0]=3 9879 B16R1.1478 C=CCOC(=O)COc1cnc(cc1Cl)Cl 7a_100009868576_100000033060 [0,2,0,0,0,0|1,0,0]=3 9880 B16R1.1478 C=CCOC(=O)COc1cnc(cc1F)F 34a_100009885687_100000033060 [0,2,0,0,0,0|1,0,0]=3 9881 B16R1.1478 C=CCOC(=O)COc1cnc(cc1F)F 7a_100009885687_100000033060 [0,2,0,0,0,0|1,0,0]=3 9882 B16R1.1478 C=CCOC(=O)COc1cnc(cc1I)Cl 34a_100000698892_100000033060 [0,2,0,0,0,0|1,0,0]=3 9883 B16R1.1478 C=CCOC(=O)COc1cnc(cc1I)Cl 7a_100000698892_100000033060 [0,2,0,0,0,0|1,0,0]=3 9884 B16R1.1478 C=CCOC(=O)COc1cnc(cc1N)Br 34a_100009819941_100000033060 [0,2,0,0,0,0|1,0,0]=3 9885 B16R1.1478 C=CCOC(=O)COc1cnc(cc1N)Br 7a_100009819941_100000033060 [0,2,0,0,0,0|1,0,0]=3 9886 B16R1.1478 C=CCOC(=O)COc1cnc(nc1C)C 34a_100009864123_100000033060 [0,2,0,0,0,0|2,0,0]=4 9887 B16R1.1478 C=CCOC(=O)COc1cnc(nc1C)C 7a_100009864123_100000033060 [0,2,0,0,0,0|2,0,0]=4 9888 B16R1.1478 C=CCOC(=O)COc1cnc(nc1Cl)Cl 34a_100010725077_100000033060 [0,2,0,0,0,0|2,0,0]=4 9889 B16R1.1478 C=CCOC(=O)COc1cnc(nc1Cl)Cl 7a_100010725077_100000033060 [0,2,0,0,0,0|2,0,0]=4 9890 B16R1.1478 C=CCOC(=O)COc1cnc(nc1N)N 7a_100025726691_100000033060 [0,2,0,0,0,0|2,0,0]=4 9891 B16R1.1478 C=CCOC(=O)COc1coc(cc1=O)C 34a_100000081520_100000033060 [0,2,0,0,0,0|1,0,0]=3 9892 B16R1.1478 C=CCOC(=O)COc1ncc(cc1Br)Br 34a_100000701035_100000033060 [0,2,0,0,0,0|1,0,0]=3 9893 B16R1.1478 C=CCOC(=O)COc1ncc(cc1Br)C 34a_100000719714_100000033060 [0,2,0,0,0,0|1,0,0]=3 9894 B16R1.1478 C=CCOC(=O)COc1ncc(cc1C)Br 34a_100000685391_100000033060 [0,2,0,0,0,0|1,0,0]=3 9895 B16R1.1478 C=CCOC(=O)COc1ncc(cc1Cl)Br 34a_100012339560_100000033060 [0,2,0,0,0,0|1,0,0]=3 9896 B16R1.1478 C=CCOC(=O)COc1ncc(cc1Cl)F 34a_100009847679_100000033060 [0,2,0,0,0,0|1,0,0]=3 9897 B16R1.1478 C=CCOC(=O)COc1ncc(cc1F)Cl 34a_100011998252_100000033060 [0,2,0,0,0,0|1,0,0]=3 9898 B16R1.1478 C=CCOC(=O)COc1ncc(cc1F)F 34a_100012025737_100000033060 [0,2,0,0,0,0|1,0,0]=3 9899 B16R1.1478 C=CCOC(=O)COc1ncc(cc1N)Br 34a_100000743729_100000033060 [0,2,0,0,0,0|1,0,0]=3 9900 B16R1.1478 C=CCOC(=O)COc1ncc(cc1N)C 34a_100012000488_100000033060 [0,2,0,0,0,0|1,0,0]=3 9901 B16R1.1478 C=CCOC(=O)COc1ncc(cc1N)Cl 34a_100011998249_100000033060 [0,2,0,0,0,0|1,0,0]=3 9902 B16R1.1478 C=CCOC(=O)COc1ncc(nc1Cl)Br 34a_100010734560_100000033060 [0,2,0,0,0,0|2,0,0]=4 9903 B16R1.1478 C=CCOC(=O)CSc1c[nH]c(=O)cc1F 62a_100000033060_100015631685 [0,2,0,0,0,0|1,1,0]=4 9904 B16R1.1478 C=CCOC(=O)CSc1c[nH]c(=O)cc1F 62a_100015631685_100000033060 [0,2,0,0,0,0|1,1,0]=4 9905 B16R1.1478 C=CCOC(=O)CSc1cc[n+](cc1C)[O-] 62a_100000033060_100000074940 [0,2,0,0,0,0|1,1,0]=4 9906 B16R1.1478 C=CCOC(=O)CSc1ccc(=O)[nH]c1N 62a_100009884077_100000033060 [0,2,0,0,0,0|1,1,0]=4 9907 B16R1.1478 C=CCOC(=O)CSc1ccc(c[n+]1[O-])C 62a_100000033060_100009819918 [0,2,0,0,0,0|1,1,0]=4 9908 B16R1.1478 C=CCOC(=O)CSc1ccc(c[n+]1[O-])F 62a_100000033060_100009817261 [0,2,0,0,0,0|1,1,0]=4 9909 B16R1.1478 C=CCOC(=O)CSc1ccc(c[n+]1[O-])F 62a_100009817261_100000033060 [0,2,0,0,0,0|1,1,0]=4 9910 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)Br 62a_100000033060_100011484698 [0,2,0,0,0,0|0,1,0]=3 9911 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)Br 62a_100011484698_100000033060 [0,2,0,0,0,0|0,1,0]=3 9912 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)C 62a_100000033060_100009813563 [0,2,0,0,0,0|0,1,0]=3 9913 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)C 62a_100009813563_100000033060 [0,2,0,0,0,0|0,1,0]=3 9914 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)Cl 62a_100000033060_100011219703 [0,2,0,0,0,0|0,1,0]=3 9915 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)Cl 62a_100011219703_100000033060 [0,2,0,0,0,0|0,1,0]=3 9916 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)F 62a_100000033060_100011217111 [0,2,0,0,0,0|0,1,0]=3 9917 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)F 62a_100011217111_100000033060 [0,2,0,0,0,0|0,1,0]=3 9918 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)N 62a_100000033060_100000750458 [0,2,0,0,0,0|0,1,0]=3 9919 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)N 62a_100000750458_100000033060 [0,2,0,0,0,0|0,1,0]=3 9920 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)O 62a_100000033060_100000701344 [0,2,0,0,0,0|0,1,0]=3 9921 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Br)O 62a_100000701344_100000033060 [0,2,0,0,0,0|0,1,0]=3 9922 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)Br 62a_100000033060_100000701812 [0,2,0,0,0,0|0,1,0]=3 9923 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)Br 62a_100000701812_100000033060 [0,2,0,0,0,0|0,1,0]=3 9924 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)C 62a_100000033060_100011217332 [0,2,0,0,0,0|0,1,0]=3 9925 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)C 62a_100011217332_100000033060 [0,2,0,0,0,0|0,1,0]=3 9926 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)Cl 62a_100000033060_100011219607 [0,2,0,0,0,0|0,1,0]=3 9927 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)Cl 62a_100011219607_100000033060 [0,2,0,0,0,0|0,1,0]=3 9928 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)F 62a_100000033060_100011205405 [0,2,0,0,0,0|0,1,0]=3 9929 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)F 62a_100011205405_100000033060 [0,2,0,0,0,0|0,1,0]=3 9930 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)N 62a_100000033060_100000210723 [0,2,0,0,0,0|0,1,0]=3 9931 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)N 62a_100000210723_100000033060 [0,2,0,0,0,0|0,1,0]=3 9932 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1C)O 62a_100000033060_100000690111 [0,2,0,0,0,0|0,1,0]=3 9933 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)Br 62a_100000033060_100011216062 [0,2,0,0,0,0|0,1,0]=3 9934 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)Br 62a_100011216062_100000033060 [0,2,0,0,0,0|0,1,0]=3 9935 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)C 62a_100000033060_100011263221 [0,2,0,0,0,0|0,1,0]=3 9936 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)C 62a_100011263221_100000033060 [0,2,0,0,0,0|0,1,0]=3 9937 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)Cl 62a_100000033060_100000699841 [0,2,0,0,0,0|0,1,0]=3 9938 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)Cl 62a_100000699841_100000033060 [0,2,0,0,0,0|0,1,0]=3 9939 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)F 62a_100000033060_100000733362 [0,2,0,0,0,0|0,1,0]=3 9940 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)F 62a_100000733362_100000033060 [0,2,0,0,0,0|0,1,0]=3 9941 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)N 62a_100000033060_100000761885 [0,2,0,0,0,0|0,1,0]=3 9942 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)N 62a_100000761885_100000033060 [0,2,0,0,0,0|0,1,0]=3 9943 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)O 62a_100000033060_100000047559 [0,2,0,0,0,0|0,1,0]=3 9944 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1Cl)O 62a_100000047559_100000033060 [0,2,0,0,0,0|0,1,0]=3 9945 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)Br 62a_100000033060_100009814013 [0,2,0,0,0,0|0,1,0]=3 9946 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)Br 62a_100009814013_100000033060 [0,2,0,0,0,0|0,1,0]=3 9947 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)C 62a_100000033060_100011216119 [0,2,0,0,0,0|0,1,0]=3 9948 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)C 62a_100011216119_100000033060 [0,2,0,0,0,0|0,1,0]=3 9949 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)Cl 62a_100000033060_100011216042 [0,2,0,0,0,0|0,1,0]=3 9950 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)Cl 62a_100011216042_100000033060 [0,2,0,0,0,0|0,1,0]=3 9951 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)F 62a_100000033060_100000750030 [0,2,0,0,0,0|0,1,0]=3 9952 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)F 62a_100000750030_100000033060 [0,2,0,0,0,0|0,1,0]=3 9953 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)N 62a_100000033060_100011356925 [0,2,0,0,0,0|0,1,0]=3 9954 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)N 62a_100011356925_100000033060 [0,2,0,0,0,0|0,1,0]=3 9955 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)O 62a_100000033060_100000755031 [0,2,0,0,0,0|0,1,0]=3 9956 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1F)O 62a_100000755031_100000033060 [0,2,0,0,0,0|0,1,0]=3 9957 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)Br 62a_100000033060_100000743836 [0,2,0,0,0,0|0,1,0]=3 9958 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)Br 62a_100000743836_100000033060 [0,2,0,0,0,0|0,1,0]=3 9959 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)C 62a_100000033060_100011216686 [0,2,0,0,0,0|0,1,0]=3 9960 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)C 62a_100011216686_100000033060 [0,2,0,0,0,0|0,1,0]=3 9961 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)Cl 62a_100000033060_100000761886 [0,2,0,0,0,0|0,1,0]=3 9962 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)Cl 62a_100000761886_100000033060 [0,2,0,0,0,0|0,1,0]=3 9963 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)F 62a_100000033060_100000687223 [0,2,0,0,0,0|0,1,0]=3 9964 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)F 62a_100000687223_100000033060 [0,2,0,0,0,0|0,1,0]=3 9965 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)N 62a_100000033060_200012175722 [0,2,0,0,0,0|0,1,0]=3 9966 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)N 62a_200012175722_100000033060 [0,2,0,0,0,0|0,1,0]=3 9967 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)O 62a_100000033060_100011999798 [0,2,0,0,0,0|0,1,0]=3 9968 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1N)O 62a_100011999798_100000033060 [0,2,0,0,0,0|0,1,0]=3 9969 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)Br 62a_100000033060_100012344904 [0,2,0,0,0,0|0,1,0]=3 9970 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)Br 62a_100012344904_100000033060 [0,2,0,0,0,0|0,1,0]=3 9971 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)C 62a_100000033060_100012002257 [0,2,0,0,0,0|0,1,0]=3 9972 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)C 62a_100012002257_100000033060 [0,2,0,0,0,0|0,1,0]=3 9973 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)Cl 62a_100000033060_100000050036 [0,2,0,0,0,0|0,1,0]=3 9974 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)Cl 62a_100000050036_100000033060 [0,2,0,0,0,0|0,1,0]=3 9975 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)F 62a_100000033060_100000690578 [0,2,0,0,0,0|0,1,0]=3 9976 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)F 62a_100000690578_100000033060 [0,2,0,0,0,0|0,1,0]=3 9977 B16R1.1478 C=CCOC(=O)CSc1ccc(cc1O)O 62a_100000033060_100009813921 [0,2,0,0,0,0|0,1,0]=3 9978 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Br)N 62a_100000033060_100010734177 [0,2,0,0,0,0|1,1,0]=4 9979 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Br)N 62a_100010734177_100000033060 [0,2,0,0,0,0|1,1,0]=4 9980 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)C 62a_100000033060_100009813853 [0,2,0,0,0,0|1,1,0]=4 9981 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)C 62a_100009813853_100000033060 [0,2,0,0,0,0|1,1,0]=4 9982 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)Cl 62a_100000033060_100000062408 [0,2,0,0,0,0|1,1,0]=4 9983 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)Cl 62a_100000062408_100000033060 [0,2,0,0,0,0|1,1,0]=4 9984 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)F 62a_100000033060_100000688911 [0,2,0,0,0,0|1,1,0]=4 9985 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)F 62a_100000688911_100000033060 [0,2,0,0,0,0|1,1,0]=4 9986 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)N 62a_100000033060_100000187202 [0,2,0,0,0,0|1,1,0]=4 9987 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)N 62a_100000187202_100000033060 [0,2,0,0,0,0|1,1,0]=4 9988 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)O 62a_100000033060_100000691680 [0,2,0,0,0,0|1,1,0]=4 9989 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1C)O 62a_100000691680_100000033060 [0,2,0,0,0,0|1,1,0]=4 9990 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Cl)Br 62a_100000033060_100010246183 [0,2,0,0,0,0|1,1,0]=4 9991 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Cl)Br 62a_100010246183_100000033060 [0,2,0,0,0,0|1,1,0]=4 9992 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Cl)Cl 62a_100000033060_100000043682 [0,2,0,0,0,0|1,1,0]=4 9993 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Cl)N 62a_100000033060_100010270343 [0,2,0,0,0,0|1,1,0]=4 9994 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1Cl)N 62a_100010270343_100000033060 [0,2,0,0,0,0|1,1,0]=4 9995 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)C 62a_100000033060_100010006597 [0,2,0,0,0,0|1,1,0]=4 9996 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)C 62a_100010006597_100000033060 [0,2,0,0,0,0|1,1,0]=4 9997 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)Cl 62a_100000033060_100010168078 [0,2,0,0,0,0|1,1,0]=4 9998 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)Cl 62a_100010168078_100000033060 [0,2,0,0,0,0|1,1,0]=4 9999 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)F 62a_100000033060_100000070099 [0,2,0,0,0,0|1,1,0]=4 10000 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)F 62a_100000070099_100000033060 [0,2,0,0,0,0|1,1,0]=4 10001 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)N 62a_100000033060_100009882772 [0,2,0,0,0,0|1,1,0]=4 10002 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)N 62a_100009882772_100000033060 [0,2,0,0,0,0|1,1,0]=4 10003 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)O 62a_100000033060_100009879308 [0,2,0,0,0,0|1,1,0]=4 10004 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1F)O 62a_100009879308_100000033060 [0,2,0,0,0,0|1,1,0]=4 10005 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)C 62a_100000033060_100009816662 [0,2,0,0,0,0|1,1,0]=4 10006 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)C 62a_100009816662_100000033060 [0,2,0,0,0,0|1,1,0]=4 10007 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)Cl 62a_100000033060_100010171640 [0,2,0,0,0,0|1,1,0]=4 10008 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)Cl 62a_100010171640_100000033060 [0,2,0,0,0,0|1,1,0]=4 10009 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)F 62a_100000033060_100009854977 [0,2,0,0,0,0|1,1,0]=4 10010 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)F 62a_100009854977_100000033060 [0,2,0,0,0,0|1,1,0]=4 10011 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1N)N 62a_100011356871_100000033060 [0,2,0,0,0,0|1,1,0]=4 10012 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1O)C 62a_100000033060_100009817604 [0,2,0,0,0,0|1,1,0]=4 10013 B16R1.1478 C=CCOC(=O)CSc1ccc(nc1O)C 62a_100009817604_100000033060 [0,2,0,0,0,0|1,1,0]=4 10014 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Br)F 62a_100000033060_100015451857 [0,2,0,0,0,0|1,1,0]=4 10015 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Br)F 62a_100015451857_100000033060 [0,2,0,0,0,0|1,1,0]=4 10016 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Br)N 62a_100000033060_100010074611 [0,2,0,0,0,0|1,1,0]=4 10017 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Br)N 62a_100010074611_100000033060 [0,2,0,0,0,0|1,1,0]=4 10018 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)Br 62a_100000033060_100009816104 [0,2,0,0,0,0|1,1,0]=4 10019 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)Br 62a_100009816104_100000033060 [0,2,0,0,0,0|1,1,0]=4 10020 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)C 62a_100000033060_100009819613 [0,2,0,0,0,0|1,1,0]=4 10021 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)C 62a_100009819613_100000033060 [0,2,0,0,0,0|1,1,0]=4 10022 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)Cl 62a_100000033060_100010172789 [0,2,0,0,0,0|1,1,0]=4 10023 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)Cl 62a_100010172789_100000033060 [0,2,0,0,0,0|1,1,0]=4 10024 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)F 62a_100000033060_100009820716 [0,2,0,0,0,0|1,1,0]=4 10025 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)F 62a_100009820716_100000033060 [0,2,0,0,0,0|1,1,0]=4 10026 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)N 62a_100000033060_100000050067 [0,2,0,0,0,0|1,1,0]=4 10027 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)N 62a_100000050067_100000033060 [0,2,0,0,0,0|1,1,0]=4 10028 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)O 62a_100000033060_100000766222 [0,2,0,0,0,0|1,1,0]=4 10029 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1C)O 62a_100000766222_100000033060 [0,2,0,0,0,0|1,1,0]=4 10030 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)Br 62a_100000033060_100010381092 [0,2,0,0,0,0|1,1,0]=4 10031 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)Br 62a_100010381092_100000033060 [0,2,0,0,0,0|1,1,0]=4 10032 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)Cl 62a_100000033060_100010200927 [0,2,0,0,0,0|1,1,0]=4 10033 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)Cl 62a_100010200927_100000033060 [0,2,0,0,0,0|1,1,0]=4 10034 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)N 62a_100000033060_100000694920 [0,2,0,0,0,0|1,1,0]=4 10035 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1Cl)N 62a_100000694920_100000033060 [0,2,0,0,0,0|1,1,0]=4 10036 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1F)Cl 62a_100000033060_100010128100 [0,2,0,0,0,0|1,1,0]=4 10037 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1F)Cl 62a_100010128100_100000033060 [0,2,0,0,0,0|1,1,0]=4 10038 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1F)N 62a_100000033060_100009844730 [0,2,0,0,0,0|1,1,0]=4 10039 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1F)N 62a_100009844730_100000033060 [0,2,0,0,0,0|1,1,0]=4 10040 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)C 62a_100000033060_100009817891 [0,2,0,0,0,0|1,1,0]=4 10041 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)C 62a_100009817891_100000033060 [0,2,0,0,0,0|1,1,0]=4 10042 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)Cl 62a_100000033060_100010209552 [0,2,0,0,0,0|1,1,0]=4 10043 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)Cl 62a_100010209552_100000033060 [0,2,0,0,0,0|1,1,0]=4 10044 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)N 62a_100000033060_200009857908 [0,2,0,0,0,0|1,1,0]=4 10045 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1N)N 62a_200009857908_100000033060 [0,2,0,0,0,0|1,1,0]=4 10046 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1O)C 62a_100000033060_100011016184 [0,2,0,0,0,0|1,1,0]=4 10047 B16R1.1478 C=CCOC(=O)CSc1cnc(cc1O)C 62a_100011016184_100000033060 [0,2,0,0,0,0|1,1,0]=4 10048 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1Br)Cl 62a_100000033060_100012154958 [0,2,0,0,0,0|1,1,0]=4 10049 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1Br)Cl 62a_100012154958_100000033060 [0,2,0,0,0,0|1,1,0]=4 10050 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)Br 62a_100000033060_100012353652 [0,2,0,0,0,0|1,1,0]=4 10051 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)Br 62a_100012353652_100000033060 [0,2,0,0,0,0|1,1,0]=4 10052 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)C 62a_100000033060_100009864548 [0,2,0,0,0,0|1,1,0]=4 10053 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)C 62a_100009864548_100000033060 [0,2,0,0,0,0|1,1,0]=4 10054 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)F 62a_100000033060_100009817009 [0,2,0,0,0,0|1,1,0]=4 10055 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)F 62a_100009817009_100000033060 [0,2,0,0,0,0|1,1,0]=4 10056 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)N 62a_100000033060_100000761747 [0,2,0,0,0,0|1,1,0]=4 10057 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)N 62a_100000761747_100000033060 [0,2,0,0,0,0|1,1,0]=4 10058 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)O 62a_100000033060_100012000486 [0,2,0,0,0,0|1,1,0]=4 10059 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1C)O 62a_100012000486_100000033060 [0,2,0,0,0,0|1,1,0]=4 10060 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)Br 62a_100000033060_100012348576 [0,2,0,0,0,0|1,1,0]=4 10061 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)Br 62a_100012348576_100000033060 [0,2,0,0,0,0|1,1,0]=4 10062 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)C 62a_100000033060_100009819633 [0,2,0,0,0,0|1,1,0]=4 10063 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)C 62a_100009819633_100000033060 [0,2,0,0,0,0|1,1,0]=4 10064 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)Cl 62a_100000033060_100012348686 [0,2,0,0,0,0|1,1,0]=4 10065 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)Cl 62a_100012348686_100000033060 [0,2,0,0,0,0|1,1,0]=4 10066 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)F 62a_100000033060_100011219543 [0,2,0,0,0,0|1,1,0]=4 10067 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)F 62a_100011219543_100000033060 [0,2,0,0,0,0|1,1,0]=4 10068 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)N 62a_100000033060_100010280766 [0,2,0,0,0,0|1,1,0]=4 10069 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)N 62a_100010280766_100000033060 [0,2,0,0,0,0|1,1,0]=4 10070 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1F)O 62a_100000033060_100000063512 [0,2,0,0,0,0|1,1,0]=4 10071 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)Br 62a_100000033060_100010090555 [0,2,0,0,0,0|1,1,0]=4 10072 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)Br 62a_100010090555_100000033060 [0,2,0,0,0,0|1,1,0]=4 10073 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)C 62a_100000033060_100000733613 [0,2,0,0,0,0|1,1,0]=4 10074 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)C 62a_100000733613_100000033060 [0,2,0,0,0,0|1,1,0]=4 10075 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)F 62a_100000033060_100009817643 [0,2,0,0,0,0|1,1,0]=4 10076 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)F 62a_100009817643_100000033060 [0,2,0,0,0,0|1,1,0]=4 10077 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)N 62a_100000033060_200000093520 [0,2,0,0,0,0|1,1,0]=4 10078 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1N)N 62a_200000093520_100000033060 [0,2,0,0,0,0|1,1,0]=4 10079 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)Br 62a_100000033060_100010210634 [0,2,0,0,0,0|1,1,0]=4 10080 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)Br 62a_100010210634_100000033060 [0,2,0,0,0,0|1,1,0]=4 10081 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)C 62a_100000033060_100012000487 [0,2,0,0,0,0|1,1,0]=4 10082 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)Cl 62a_100000033060_100010233512 [0,2,0,0,0,0|1,1,0]=4 10083 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)Cl 62a_100010233512_100000033060 [0,2,0,0,0,0|1,1,0]=4 10084 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)F 62a_100000033060_100000079967 [0,2,0,0,0,0|1,1,0]=4 10085 B16R1.1478 C=CCOC(=O)CSc1ncc(cc1O)F 62a_100009820119_100000033060 [0,2,0,0,0,0|1,1,0]=4 10086 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)Br 34a_100000188717_200011215008 [0,2,0,0,0,0|0,0,2]=4 10087 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)Br 7a_100000188717_200011215008 [0,2,0,0,0,0|0,0,2]=4 10088 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)C 34a_100000210800_200011215008 [0,2,0,0,0,0|0,0,2]=4 10089 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)C 7a_100000210800_200011215008 [0,2,0,0,0,0|0,0,2]=4 10090 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)Cl 34a_100000211998_200011215008 [0,2,0,0,0,0|0,0,2]=4 10091 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)Cl 7a_100000211998_200011215008 [0,2,0,0,0,0|0,0,2]=4 10092 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)F 34a_100000211999_200011215008 [0,2,0,0,0,0|0,0,2]=4 10093 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)F 7a_100000211999_200011215008 [0,2,0,0,0,0|0,0,2]=4 10094 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)I 34a_100012361655_200011215008 [0,2,0,0,0,0|0,0,2]=4 10095 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)I 7a_100012361655_200011215008 [0,2,0,0,0,0|0,0,2]=4 10096 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)N 34a_100011534360_200011215008 [0,2,0,0,0,0|0,0,2]=4 10097 B16R1.1478 CCCOC(=O)COc1ccc(cc1Br)N 7a_100011534360_200011215008 [0,2,0,0,0,0|0,0,2]=4 10098 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)Br 34a_100000186361_200011215008 [0,2,0,0,0,0|0,0,2]=4 10099 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)Br 7a_100000186361_200011215008 [0,2,0,0,0,0|0,0,2]=4 10100 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)C 34a_100000211776_200011215008 [0,2,0,0,0,0|0,0,2]=4 10101 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)C 7a_100000211776_200011215008 [0,2,0,0,0,0|0,0,2]=4 10102 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)Cl 34a_100000211091_200011215008 [0,2,0,0,0,0|0,0,2]=4 10103 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)Cl 7a_100000211091_200011215008 [0,2,0,0,0,0|0,0,2]=4 10104 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)F 34a_100000764316_200011215008 [0,2,0,0,0,0|0,0,2]=4 10105 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)F 7a_100000764316_200011215008 [0,2,0,0,0,0|0,0,2]=4 10106 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)I 34a_100011218673_200011215008 [0,2,0,0,0,0|0,0,2]=4 10107 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)I 7a_100011218673_200011215008 [0,2,0,0,0,0|0,0,2]=4 10108 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)N 34a_100011218179_200011215008 [0,2,0,0,0,0|0,0,2]=4 10109 B16R1.1478 CCCOC(=O)COc1ccc(cc1C)N 7a_100011218179_200011215008 [0,2,0,0,0,0|0,0,2]=4 10110 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)Br 34a_100000186472_200011215008 [0,2,0,0,0,0|0,0,2]=4 10111 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)Br 7a_100000186472_200011215008 [0,2,0,0,0,0|0,0,2]=4 10112 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)C 34a_100000749699_200011215008 [0,2,0,0,0,0|0,0,2]=4 10113 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)C 7a_100000749699_200011215008 [0,2,0,0,0,0|0,0,2]=4 10114 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)Cl 34a_100015191787_200011215008 [0,2,0,0,0,0|0,0,2]=4 10115 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)Cl 7a_100015191787_200011215008 [0,2,0,0,0,0|0,0,2]=4 10116 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)F 34a_100000212004_200011215008 [0,2,0,0,0,0|0,0,2]=4 10117 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)F 7a_100000212004_200011215008 [0,2,0,0,0,0|0,0,2]=4 10118 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)I 34a_100012360047_200011215008 [0,2,0,0,0,0|0,0,2]=4 10119 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)I 7a_100012360047_200011215008 [0,2,0,0,0,0|0,0,2]=4 10120 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)N 34a_100000744943_200011215008 [0,2,0,0,0,0|0,0,2]=4 10121 B16R1.1478 CCCOC(=O)COc1ccc(cc1Cl)N 7a_100000744943_200011215008 [0,2,0,0,0,0|0,0,2]=4 10122 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)Br 34a_100000185481_200011215008 [0,2,0,0,0,0|0,0,2]=4 10123 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)Br 7a_100000185481_200011215008 [0,2,0,0,0,0|0,0,2]=4 10124 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)C 34a_100011216688_200011215008 [0,2,0,0,0,0|0,0,2]=4 10125 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)C 7a_100011216688_200011215008 [0,2,0,0,0,0|0,0,2]=4 10126 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)Cl 34a_100000230166_200011215008 [0,2,0,0,0,0|0,0,2]=4 10127 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)Cl 7a_100000230166_200011215008 [0,2,0,0,0,0|0,0,2]=4 10128 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)F 34a_100000230127_200011215008 [0,2,0,0,0,0|0,0,2]=4 10129 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)F 7a_100000230127_200011215008 [0,2,0,0,0,0|0,0,2]=4 10130 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)I 34a_100011356965_200011215008 [0,2,0,0,0,0|0,0,2]=4 10131 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)I 7a_100011356965_200011215008 [0,2,0,0,0,0|0,0,2]=4 10132 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)N 34a_100011220035_200011215008 [0,2,0,0,0,0|0,0,2]=4 10133 B16R1.1478 CCCOC(=O)COc1ccc(cc1F)N 7a_100011220035_200011215008 [0,2,0,0,0,0|0,0,2]=4 10134 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)Br 34a_100012355227_200011215008 [0,2,0,0,0,0|0,0,2]=4 10135 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)Br 7a_100012355227_200011215008 [0,2,0,0,0,0|0,0,2]=4 10136 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)C 34a_100000765521_200011215008 [0,2,0,0,0,0|0,0,2]=4 10137 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)C 7a_100000765521_200011215008 [0,2,0,0,0,0|0,0,2]=4 10138 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)Cl 34a_100011356953_200011215008 [0,2,0,0,0,0|0,0,2]=4 10139 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)Cl 7a_100011356953_200011215008 [0,2,0,0,0,0|0,0,2]=4 10140 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)F 34a_100012355409_200011215008 [0,2,0,0,0,0|0,0,2]=4 10141 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)F 7a_100012355409_200011215008 [0,2,0,0,0,0|0,0,2]=4 10142 B16R1.1478 CCCOC(=O)COc1ccc(cc1I)I 7a_100010001573_200011215008 [0,2,0,0,0,0|0,0,2]=4 10143 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)Br 34a_100000752626_200011215008 [0,2,0,0,0,0|0,0,2]=4 10144 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)Br 7a_100000752626_200011215008 [0,2,0,0,0,0|0,0,2]=4 10145 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)C 34a_100011215204_200011215008 [0,2,0,0,0,0|0,0,2]=4 10146 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)C 7a_100011215204_200011215008 [0,2,0,0,0,0|0,0,2]=4 10147 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)Cl 34a_100000210500_200011215008 [0,2,0,0,0,0|0,0,2]=4 10148 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)Cl 7a_100000210500_200011215008 [0,2,0,0,0,0|0,0,2]=4 10149 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)F 34a_100000759472_200011215008 [0,2,0,0,0,0|0,0,2]=4 10150 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)F 7a_100000759472_200011215008 [0,2,0,0,0,0|0,0,2]=4 10151 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)I 34a_100000753495_200011215008 [0,2,0,0,0,0|0,0,2]=4 10152 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)I 7a_100000753495_200011215008 [0,2,0,0,0,0|0,0,2]=4 10153 B16R1.1478 CCCOC(=O)COc1ccc(cc1N)N 34a_100000725306_200011215008 [0,2,0,0,0,0|0,0,2]=4 10154 B16R1.1480 C#Cc1ccc(cc1)NCC(=O)OCC=C 34a_100011215031_100000033060 [0,2,0,0,0,0|1,0,0]=3 10155 B16R1.1480 C#Cc1ccc(nc1)OCC(=O)OCC=C 34a_200009884252_100000033060 [0,2,0,0,0,0|1,0,0]=3 10156 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)C#N 1458a_100000021948_100000754431 [0,2,0,0,0,0|2,0,0]=4 10157 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)C#N 1458a_100000749702_100012161189 [0,2,0,0,0,0|2,0,0]=4 10158 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)C=C 1458a_100000749702_100000142037 [0,2,0,0,0,0|2,0,0]=4 10159 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)CC 1458a_100000195522_100000754431 [0,2,0,0,0,0|2,0,0]=4 10160 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)OC 1458a_100000211712_100000754431 [0,2,0,0,0,0|2,0,0]=4 10161 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)OC 1458a_100000749702_100000184700 [0,2,0,0,0,0|2,0,0]=4 10162 B16R1.1480 C=CCCC(=O)CCc1ccc(cc1)SC 1458a_100011252364_100000754431 [0,2,0,0,0,0|2,0,0]=4 10163 B16R1.1480 C=CCCC(=O)COc1ccc(cc1)C#N 1458a_100000182482_100000754431 [0,2,0,0,0,0|1,0,0]=3 10164 B16R1.1480 C=CCCC(=O)COc1ccc(cc1)CC 1458a_100000182499_100000754431 [0,2,0,0,0,0|1,0,0]=3 10165 B16R1.1480 C=CCCC(=O)COc1ccc(cc1)CO 1458a_100000730898_100000754431 [0,2,0,0,0,0|1,0,0]=3 10166 B16R1.1480 C=CCCC(=O)COc1ccc(cc1)OC 1458a_100000186439_100000754431 [0,2,0,0,0,0|1,0,0]=3 10167 B16R1.1480 C=CCCC(=O)CSc1ccc(cc1)OC 1458a_100000182033_100000754431 [0,2,0,0,0,0|1,1,0]=4 10168 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)C#N 1626a_100020586998_100000021948 [0,2,0,0,0,0|2,0,0]=4 10169 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)C#N 240690a_100020586998_100000021948 [0,2,0,0,0,0|2,0,0]=4 10170 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)C#N 527a_100020586998_100000021948 [0,2,0,0,0,0|2,0,0]=4 10171 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)CC 1626a_100020586998_100000195522 [0,2,0,0,0,0|2,0,0]=4 10172 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)CC 240690a_100020586998_100000195522 [0,2,0,0,0,0|2,0,0]=4 10173 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)CC 527a_100020586998_100000195522 [0,2,0,0,0,0|2,0,0]=4 10174 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)OC 1626a_100020586998_100000211712 [0,2,0,0,0,0|2,0,0]=4 10175 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)OC 240690a_100020586998_100000211712 [0,2,0,0,0,0|2,0,0]=4 10176 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)OC 527a_100020586998_100000211712 [0,2,0,0,0,0|2,0,0]=4 10177 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)SC 1626a_100020586998_100011252364 [0,2,0,0,0,0|2,0,0]=4 10178 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)SC 240690a_100020586998_100011252364 [0,2,0,0,0,0|2,0,0]=4 10179 B16R1.1480 C=CCNC(=O)CCc1ccc(cc1)SC 527a_100020586998_100011252364 [0,2,0,0,0,0|2,0,0]=4 10180 B16R1.1480 C=CCNC(=O)CNc1ccc(cc1)CC 2230a_100000211069_100000183597 [0,2,0,0,0,0|2,0,0]=4 10181 B16R1.1480 C=CCNC(=O)CNc1ccc(cc1)CO 2230a_100011215238_100000183597 [0,2,0,0,0,0|2,0,0]=4 10182 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)C#N 1626a_100020586998_100000182482 [0,2,0,0,0,0|1,0,0]=3 10183 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)C#N 240690a_100020586998_100000182482 [0,2,0,0,0,0|1,0,0]=3 10184 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)C#N 527a_100020586998_100000182482 [0,2,0,0,0,0|1,0,0]=3 10185 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)C#N 7a_100000210344_100000183597 [0,2,0,0,0,0|1,0,0]=3 10186 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)C=C 7a_100000189437_100000183597 [0,2,0,0,0,0|1,0,0]=3 10187 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)CC 1626a_100020586998_100000182499 [0,2,0,0,0,0|1,0,0]=3 10188 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)CC 240690a_100020586998_100000182499 [0,2,0,0,0,0|1,0,0]=3 10189 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)CC 527a_100020586998_100000182499 [0,2,0,0,0,0|1,0,0]=3 10190 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)CC 7a_100000211359_100000183597 [0,2,0,0,0,0|1,0,0]=3 10191 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)CO 240690a_100020586998_100000730898 [0,2,0,0,0,0|1,0,0]=3 10192 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)OC 1626a_100020586998_100000186439 [0,2,0,0,0,0|1,0,0]=3 10193 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)OC 240690a_100020586998_100000186439 [0,2,0,0,0,0|1,0,0]=3 10194 B16R1.1480 C=CCNC(=O)COc1ccc(cc1)OC 527a_100020586998_100000186439 [0,2,0,0,0,0|1,0,0]=3 10195 B16R1.1480 C=CCNC(=O)COc1ccc(nc1)C#N 7a_100011934750_100000183597 [0,2,0,0,0,0|2,0,0]=4 10196 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)C#N 62a_100000183597_100000184291 [0,2,0,0,0,0|1,1,0]=4 10197 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)C=C 62a_100000183597_100000748128 [0,2,0,0,0,0|1,1,0]=4 10198 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)C=C 62a_100000748128_100000183597 [0,2,0,0,0,0|1,1,0]=4 10199 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)C=O 62a_100000183597_100000188517 [0,2,0,0,0,0|1,1,0]=4 10200 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000183597 [0,2,0,0,0,0|1,1,0]=4 10201 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CC 62a_100000183597_100011215824 [0,2,0,0,0,0|1,1,0]=4 10202 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CC 62a_100011215824_100000183597 [0,2,0,0,0,0|1,1,0]=4 10203 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CF 62a_100000183597_100010268989 [0,2,0,0,0,0|1,1,0]=4 10204 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000183597 [0,2,0,0,0,0|1,1,0]=4 10205 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CN 62a_100000183597_100016989417 [0,2,0,0,0,0|1,1,0]=4 10206 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CN 62a_100016989417_100000183597 [0,2,0,0,0,0|1,1,0]=4 10207 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CO 62a_100000183597_100000690907 [0,2,0,0,0,0|1,1,0]=4 10208 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000183597 [0,2,0,0,0,0|1,1,0]=4 10209 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)NC 62a_100000183597_100000743151 [0,2,0,0,0,0|1,1,0]=4 10210 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)NC 62a_100000743151_100000183597 [0,2,0,0,0,0|1,1,0]=4 10211 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)NN 62a_100000183597_100016988836 [0,2,0,0,0,0|1,1,0]=4 10212 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)NN 62a_100016988836_100000183597 [0,2,0,0,0,0|1,1,0]=4 10213 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)OC 1626a_100020586998_100000182033 [0,2,0,0,0,0|1,1,0]=4 10214 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)OC 240690a_100020586998_100000182033 [0,2,0,0,0,0|1,1,0]=4 10215 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)OC 527a_100020586998_100000182033 [0,2,0,0,0,0|1,1,0]=4 10216 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)OC 62a_100000183597_100000171711 [0,2,0,0,0,0|1,1,0]=4 10217 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)SC 62a_100000183597_100011263217 [0,2,0,0,0,0|1,1,0]=4 10218 B16R1.1480 C=CCNC(=O)CSc1ccc(cc1)SC 62a_100011263217_100000183597 [0,2,0,0,0,0|1,1,0]=4 10219 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)C#N 34a_100000185469_100000033060 [0,2,0,0,0,0|1,0,0]=3 10220 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)C=C 34a_100011218248_100000033060 [0,2,0,0,0,0|1,0,0]=3 10221 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)CC 2230a_100000211069_100000033060 [0,2,0,0,0,0|1,0,0]=3 10222 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)CC 34a_100000211069_100000033060 [0,2,0,0,0,0|1,0,0]=3 10223 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)CO 2230a_100011215238_100000033060 [0,2,0,0,0,0|1,0,0]=3 10224 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)CO 34a_100011215238_100000033060 [0,2,0,0,0,0|1,0,0]=3 10225 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)OC 34a_100000184247_100000033060 [0,2,0,0,0,0|1,0,0]=3 10226 B16R1.1480 C=CCOC(=O)CNc1ccc(cc1)SC 34a_100000212337_100000033060 [0,2,0,0,0,0|1,0,0]=3 10227 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)C#N 34a_100000210344_100000033060 [0,2,0,0,0,0|0,0,0]=2 10228 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)C#N 7a_100000210344_100000033060 [0,2,0,0,0,0|0,0,0]=2 10229 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)C=C 34a_100000189437_100000033060 [0,2,0,0,0,0|0,0,0]=2 10230 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)C=C 7a_100000189437_100000033060 [0,2,0,0,0,0|0,0,0]=2 10231 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)CC 34a_100000211359_100000033060 [0,2,0,0,0,0|0,0,0]=2 10232 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)CC 7a_100000211359_100000033060 [0,2,0,0,0,0|0,0,0]=2 10233 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)CN 34a_100000185549_100000033060 [0,2,0,0,0,0|0,0,0]=2 10234 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)CO 34a_100000211755_100000033060 [0,2,0,0,0,0|0,0,0]=2 10235 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)NC 34a_100000182112_100000033060 [0,2,0,0,0,0|0,0,0]=2 10236 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)OC 34a_100000210503_100000033060 [0,2,0,0,0,0|0,0,0]=2 10237 B16R1.1480 C=CCOC(=O)COc1ccc(cc1)SC 34a_100000211864_100000033060 [0,2,0,0,0,0|0,0,0]=2 10238 B16R1.1480 C=CCOC(=O)COc1ccc(cn1)CN 34a_100000757128_100000033060 [0,2,0,0,0,0|1,0,0]=3 10239 B16R1.1480 C=CCOC(=O)COc1ccc(cn1)OC 34a_100012002028_100000033060 [0,2,0,0,0,0|1,0,0]=3 10240 B16R1.1480 C=CCOC(=O)COc1ccc(nc1)C#N 34a_100011934750_100000033060 [0,2,0,0,0,0|1,0,0]=3 10241 B16R1.1480 C=CCOC(=O)COc1ccc(nc1)C#N 7a_100011934750_100000033060 [0,2,0,0,0,0|1,0,0]=3 10242 B16R1.1480 C=CCOC(=O)COc1ccc(nc1)CN 34a_100020605196_100000033060 [0,2,0,0,0,0|1,0,0]=3 10243 B16R1.1480 C=CCOC(=O)COc1ccc(nc1)CO 34a_103436540053_100000033060 [0,2,0,0,0,0|1,0,0]=3 10244 B16R1.1480 C=CCOC(=O)COc1ccc(nc1)OC 34a_100011934560_100000033060 [0,2,0,0,0,0|1,0,0]=3 10245 B16R1.1480 C=CCOC(=O)COc1cnc(nc1)C#N 7a_100000707606_100000033060 [0,2,0,0,0,0|2,0,0]=4 10246 B16R1.1480 C=CCOC(=O)COc1cnc(nc1)OC 34a_100000099601_100000033060 [0,2,0,0,0,0|2,0,0]=4 10247 B16R1.1480 C=CCOC(=O)COc1cnc(nc1)OC 7a_100000099601_100000033060 [0,2,0,0,0,0|2,0,0]=4 10248 B16R1.1480 C=CCOC(=O)COc1cnc(nc1)SC 34a_100000075549_100000033060 [0,2,0,0,0,0|2,0,0]=4 10249 B16R1.1480 C=CCOC(=O)COc1cnc(nc1)SC 7a_100000075549_100000033060 [0,2,0,0,0,0|2,0,0]=4 10250 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)C#N 62a_100000033060_100000184291 [0,2,0,0,0,0|0,1,0]=3 10251 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)C=C 62a_100000033060_100000748128 [0,2,0,0,0,0|0,1,0]=3 10252 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)C=C 62a_100000748128_100000033060 [0,2,0,0,0,0|0,1,0]=3 10253 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)C=O 62a_100000033060_100000188517 [0,2,0,0,0,0|0,1,0]=3 10254 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000033060 [0,2,0,0,0,0|0,1,0]=3 10255 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CC 62a_100000033060_100011215824 [0,2,0,0,0,0|0,1,0]=3 10256 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CC 62a_100011215824_100000033060 [0,2,0,0,0,0|0,1,0]=3 10257 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CF 62a_100000033060_100010268989 [0,2,0,0,0,0|0,1,0]=3 10258 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000033060 [0,2,0,0,0,0|0,1,0]=3 10259 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CN 62a_100000033060_100016989417 [0,2,0,0,0,0|0,1,0]=3 10260 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CN 62a_100016989417_100000033060 [0,2,0,0,0,0|0,1,0]=3 10261 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CO 62a_100000033060_100000690907 [0,2,0,0,0,0|0,1,0]=3 10262 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000033060 [0,2,0,0,0,0|0,1,0]=3 10263 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)NC 62a_100000033060_100000743151 [0,2,0,0,0,0|0,1,0]=3 10264 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)NC 62a_100000743151_100000033060 [0,2,0,0,0,0|0,1,0]=3 10265 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)NN 62a_100000033060_100016988836 [0,2,0,0,0,0|0,1,0]=3 10266 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)NN 62a_100016988836_100000033060 [0,2,0,0,0,0|0,1,0]=3 10267 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)OC 62a_100000033060_100000171711 [0,2,0,0,0,0|0,1,0]=3 10268 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)SC 62a_100000033060_100011263217 [0,2,0,0,0,0|0,1,0]=3 10269 B16R1.1480 C=CCOC(=O)CSc1ccc(cc1)SC 62a_100011263217_100000033060 [0,2,0,0,0,0|0,1,0]=3 10270 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)C#N 62a_100000033060_100000241038 [0,2,0,0,0,0|1,1,0]=4 10271 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)C=C 62a_100000033060_103436540071 [0,2,0,0,0,0|1,1,0]=4 10272 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)C=C 62a_103436540071_100000033060 [0,2,0,0,0,0|1,1,0]=4 10273 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)C=O 62a_100000033060_100000766901 [0,2,0,0,0,0|1,1,0]=4 10274 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)C=O 62a_100000766901_100000033060 [0,2,0,0,0,0|1,1,0]=4 10275 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CC 62a_100000033060_100009843584 [0,2,0,0,0,0|1,1,0]=4 10276 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CC 62a_100009843584_100000033060 [0,2,0,0,0,0|1,1,0]=4 10277 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CN 62a_100000033060_100000735879 [0,2,0,0,0,0|1,1,0]=4 10278 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CN 62a_100000735879_100000033060 [0,2,0,0,0,0|1,1,0]=4 10279 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CO 62a_100000033060_100009816760 [0,2,0,0,0,0|1,1,0]=4 10280 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)CO 62a_100009816760_100000033060 [0,2,0,0,0,0|1,1,0]=4 10281 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)NC 62a_100000033060_100000764248 [0,2,0,0,0,0|1,1,0]=4 10282 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)NC 62a_100000764248_100000033060 [0,2,0,0,0,0|1,1,0]=4 10283 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)NN 62a_100000033060_100000119030 [0,2,0,0,0,0|1,1,0]=4 10284 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)NN 62a_100000755011_100000033060 [0,2,0,0,0,0|1,1,0]=4 10285 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)OC 62a_100000033060_100000744180 [0,2,0,0,0,0|1,1,0]=4 10286 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)OC 62a_100000755202_100000033060 [0,2,0,0,0,0|1,1,0]=4 10287 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)SC 62a_100000033060_100009820866 [0,2,0,0,0,0|1,1,0]=4 10288 B16R1.1480 C=CCOC(=O)CSc1ccc(cn1)SC 62a_100009820866_100000033060 [0,2,0,0,0,0|1,1,0]=4 10289 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)C#N 62a_100000033060_100000760455 [0,2,0,0,0,0|1,1,0]=4 10290 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)C=O 62a_100000033060_100000754260 [0,2,0,0,0,0|1,1,0]=4 10291 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)C=O 62a_100000754260_100000033060 [0,2,0,0,0,0|1,1,0]=4 10292 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CC 62a_100000033060_100009820025 [0,2,0,0,0,0|1,1,0]=4 10293 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CC 62a_100009820025_100000033060 [0,2,0,0,0,0|1,1,0]=4 10294 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CN 62a_100000033060_100015188789 [0,2,0,0,0,0|1,1,0]=4 10295 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CN 62a_100015188789_100000033060 [0,2,0,0,0,0|1,1,0]=4 10296 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CO 62a_100000033060_100000754261 [0,2,0,0,0,0|1,1,0]=4 10297 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)CO 62a_100000754261_100000033060 [0,2,0,0,0,0|1,1,0]=4 10298 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)NC 62a_100000033060_100000741341 [0,2,0,0,0,0|1,1,0]=4 10299 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)NC 62a_100000741341_100000033060 [0,2,0,0,0,0|1,1,0]=4 10300 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)NN 62a_100000033060_100000750576 [0,2,0,0,0,0|1,1,0]=4 10301 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)NN 62a_100000750576_100000033060 [0,2,0,0,0,0|1,1,0]=4 10302 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)OC 62a_100000033060_100000047065 [0,2,0,0,0,0|1,1,0]=4 10303 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)OC 62a_100000047065_100000033060 [0,2,0,0,0,0|1,1,0]=4 10304 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)SC 62a_100000033060_100011408404 [0,2,0,0,0,0|1,1,0]=4 10305 B16R1.1480 C=CCOC(=O)CSc1ccc(nc1)SC 62a_100011408404_100000033060 [0,2,0,0,0,0|1,1,0]=4 10306 B16R1.1480 C=CCOC(C)COc1ccc(cc1)OC 34a_200011216264_100015514636 [0,2,0,0,0,0|1,0,1]=4 10307 B16R1.1480 C=CCOC(C)COc1ccc(cc1)OC 7a_200011216264_100015514636 [0,2,0,0,0,0|1,0,1]=4 10308 B16R1.1480 C=Cc1ccc(cc1)OCC(=O)OCCC 34a_100000189437_200011215008 [0,2,0,0,0,0|0,0,2]=4 10309 B16R1.1480 C=Cc1ccc(cc1)OCC(=O)OCCC 7a_100000189437_200011215008 [0,2,0,0,0,0|0,0,2]=4 10310 B16R1.1480 CCCOC(=O)COc1ccc(cc1)C#N 34a_100000210344_200011215008 [0,2,0,0,0,0|0,0,2]=4 10311 B16R1.1480 CCCOC(=O)COc1ccc(cc1)C#N 7a_100000210344_200011215008 [0,2,0,0,0,0|0,0,2]=4 10312 B16R1.1480 CCCOC(=O)COc1ccc(cc1)CC 34a_100000211359_200011215008 [0,2,0,0,0,0|0,0,2]=4 10313 B16R1.1480 CCCOC(=O)COc1ccc(cc1)CC 7a_100000211359_200011215008 [0,2,0,0,0,0|0,0,2]=4 10314 B16R1.1480 CCCOC(=O)COc1ccc(cc1)CN 34a_100000185549_200011215008 [0,2,0,0,0,0|0,0,2]=4 10315 B16R1.1480 CCCOC(=O)COc1ccc(cc1)CO 34a_100000211755_200011215008 [0,2,0,0,0,0|0,0,2]=4 10316 B16R1.1480 CCCOC(=O)COc1ccc(cc1)NC 34a_100000182112_200011215008 [0,2,0,0,0,0|0,0,2]=4 10317 B16R1.1480 CCCOC(=O)COc1ccc(cc1)OC 34a_100000210503_200011215008 [0,2,0,0,0,0|0,0,2]=4 10318 B16R1.1480 CCCOC(=O)COc1ccc(cc1)SC 34a_100000211864_200011215008 [0,2,0,0,0,0|0,0,2]=4 10319 B16R1.126 C=CCCC(=O)C(C#N)Cc1ccccc1 1458a_100000075392_100000754431 [0,2,0,0,0,0|2,0,0]=4 10320 B16R1.126 C=CCCC(=O)C(C#N)Cc1ccccc1 1458a_100000749702_100000183401 [0,2,0,0,0,0|2,0,0]=4 10321 B16R1.126 C=CCCC(=O)C(CC)Oc1ccccc1 1458a_100000211556_100000754431 [0,2,0,0,0,0|1,0,0]=3 10322 B16R1.126 C=CCCC(=O)C(CC)Sc1ccccc1 1458a_100000230495_100000754431 [0,2,0,0,0,0|1,1,0]=4 10323 B16R1.126 C=CCNC(=O)C(C#N)Cc1ccccc1 1626a_100020586998_100000075392 [0,2,0,0,0,0|2,0,0]=4 10324 B16R1.126 C=CCNC(=O)C(C#N)Cc1ccccc1 240690a_100020586998_100000075392 [0,2,0,0,0,0|2,0,0]=4 10325 B16R1.126 C=CCNC(=O)C(C#N)Cc1ccccc1 527a_100020586998_100000075392 [0,2,0,0,0,0|2,0,0]=4 10326 B16R1.126 C=CCNC(=O)C(CC)Oc1ccccc1 1626a_100020586998_100000211556 [0,2,0,0,0,0|1,0,0]=3 10327 B16R1.126 C=CCNC(=O)C(CC)Oc1ccccc1 240690a_100020586998_100000211556 [0,2,0,0,0,0|1,0,0]=3 10328 B16R1.126 C=CCNC(=O)C(CC)Oc1ccccc1 527a_100020586998_100000211556 [0,2,0,0,0,0|1,0,0]=3 10329 B16R1.126 C=CCNC(=O)C(CC)Sc1ccccc1 1626a_100020586998_100000230495 [0,2,0,0,0,0|1,1,0]=4 10330 B16R1.126 C=CCNC(=O)C(CC)Sc1ccccc1 240690a_100020586998_100000230495 [0,2,0,0,0,0|1,1,0]=4 10331 B16R1.126 C=CCNC(=O)C(CC)Sc1ccccc1 527a_100020586998_100000230495 [0,2,0,0,0,0|1,1,0]=4 10332 B16R1.945 C=CCC(C)C(=O)C(C)Cc1ccccc1 1458a_100011216819_200011218536 [0,2,0,0,0,0|2,0,0]=4 10333 B16R1.945 C=CCN(C)C(=O)C(C)Cc1ccccc1 11a_100000225617_100000754839 [0,2,0,0,0,0|2,0,0]=4 10334 B16R1.945 C=CCN(C)C(=O)C(C)Cc1ccccc1 1626a_100000225617_100000754839 [0,2,0,0,0,0|2,0,0]=4 10335 B16R1.945 C=CCN(C)C(=O)C(C)Cc1ccccc1 240690a_100000225617_100000754839 [0,2,0,0,0,0|2,0,0]=4 10336 B16R1.945 C=CCN(C)C(=O)C(C)Cc1ccccc1 527a_100000225617_100000754839 [0,2,0,0,0,0|2,0,0]=4 10337 B16R1.945 C=CCN(C)C(=O)C(C)Oc1ccccc1 11a_100000225617_100000188414 [0,2,0,0,0,0|1,0,0]=3 10338 B16R1.945 C=CCN(C)C(=O)C(C)Oc1ccccc1 1626a_100000225617_100000188414 [0,2,0,0,0,0|1,0,0]=3 10339 B16R1.945 C=CCN(C)C(=O)C(C)Oc1ccccc1 240690a_100000225617_100000188414 [0,2,0,0,0,0|1,0,0]=3 10340 B16R1.945 C=CCN(C)C(=O)C(C)Oc1ccccc1 527a_100000225617_100000188414 [0,2,0,0,0,0|1,0,0]=3 10341 B16R1.945 C=CCN(C)C(=O)C(C)Sc1ccccc1 11a_100000225617_100000199063 [0,2,0,0,0,0|1,1,0]=4 10342 B16R1.945 C=CCN(C)C(=O)C(C)Sc1ccccc1 1626a_100000225617_100000199063 [0,2,0,0,0,0|1,1,0]=4 10343 B16R1.945 C=CCN(C)C(=O)C(C)Sc1ccccc1 240690a_100000225617_100000199063 [0,2,0,0,0,0|1,1,0]=4 10344 B16R1.945 C=CCN(C)C(=O)C(C)Sc1ccccc1 527a_100000225617_100000199063 [0,2,0,0,0,0|1,1,0]=4 10345 B16R1.945 C=CCN(C)C(=O)[C@H](O)Cc1ccccc1 240690a_100000225617_100009816399 [0,2,0,0,0,0|2,0,0]=4 10346 B16R1.1127 C=CC(C)CC(=O)C(C)Cc1ccccc1 1458a_100011934298_200011218536 [0,2,0,0,0,0|2,0,0]=4 10347 B16R1.1284 C=C(C)CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000730704 [0,2,0,0,0,0|2,0,0]=4 10348 B16R1.1284 C=C(C)CCC(=O)C(C)Cc1ccccc1 1458a_200000688413_200011218536 [0,2,0,0,0,0|2,0,0]=4 10349 B16R1.1284 C=C(C)CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000730704 [0,2,0,0,0,0|1,0,0]=3 10350 B16R1.1284 C=C(C)CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000730704 [0,2,0,0,0,0|1,1,0]=4 10351 B16R1.1284 C=C(C)CCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000730704 [0,2,0,0,0,0|2,0,0]=4 10352 B16R1.1284 C=C(C)CNC(=O)C(C)Cc1ccccc1 11a_100000765925_100000754839 [0,2,0,0,0,0|2,0,0]=4 10353 B16R1.1284 C=C(C)CNC(=O)C(C)Cc1ccccc1 1626a_100000765925_100000754839 [0,2,0,0,0,0|2,0,0]=4 10354 B16R1.1284 C=C(C)CNC(=O)C(C)Cc1ccccc1 240690a_100000765925_100000754839 [0,2,0,0,0,0|2,0,0]=4 10355 B16R1.1284 C=C(C)CNC(=O)C(C)Cc1ccccc1 527a_100000765925_100000754839 [0,2,0,0,0,0|2,0,0]=4 10356 B16R1.1284 C=C(C)CNC(=O)C(C)Oc1ccccc1 11a_100000765925_100000188414 [0,2,0,0,0,0|1,0,0]=3 10357 B16R1.1284 C=C(C)CNC(=O)C(C)Oc1ccccc1 1626a_100000765925_100000188414 [0,2,0,0,0,0|1,0,0]=3 10358 B16R1.1284 C=C(C)CNC(=O)C(C)Oc1ccccc1 240690a_100000765925_100000188414 [0,2,0,0,0,0|1,0,0]=3 10359 B16R1.1284 C=C(C)CNC(=O)C(C)Oc1ccccc1 527a_100000765925_100000188414 [0,2,0,0,0,0|1,0,0]=3 10360 B16R1.1284 C=C(C)CNC(=O)C(C)Sc1ccccc1 11a_100000765925_100000199063 [0,2,0,0,0,0|1,1,0]=4 10361 B16R1.1284 C=C(C)CNC(=O)C(C)Sc1ccccc1 1626a_100000765925_100000199063 [0,2,0,0,0,0|1,1,0]=4 10362 B16R1.1284 C=C(C)CNC(=O)C(C)Sc1ccccc1 240690a_100000765925_100000199063 [0,2,0,0,0,0|1,1,0]=4 10363 B16R1.1284 C=C(C)CNC(=O)C(C)Sc1ccccc1 527a_100000765925_100000199063 [0,2,0,0,0,0|1,1,0]=4 10364 B16R1.1284 C=C(C)CNC(=O)[C@H](O)Cc1ccccc1 240690a_100000765925_100009816399 [0,2,0,0,0,0|2,0,0]=4 10365 B16R1.1284 CC(Oc1ccccc1)C(=O)NCC(=O)N 11a_100000711301_100000188414 [0,2,0,0,0,0|2,0,0]=4 10366 B16R1.1284 CC(Oc1ccccc1)C(=O)NCC(=O)N 240690a_100000711301_100000188414 [0,2,0,0,0,0|2,0,0]=4 10367 B16R1.1284 CC(Oc1ccccc1)C(=O)NCC(=O)N 527a_100000711301_100000188414 [0,2,0,0,0,0|2,0,0]=4 10368 B16R1.1793 C=CC=CC(=O)C(F)(F)Oc1ccccc1 1458a_100016291481_200000057402 [0,2,0,0,0,0|1,0,1]=4 10369 B16R1.1793 C=CCCC(=O)C(C)(C)Cc1ccccc1 1458a_100000757416_100000754431 [0,2,0,0,0,0|2,0,0]=4 10370 B16R1.1793 C=CCCC(=O)C(C)(C)Oc1ccccc1 1458a_100000743201_100000754431 [0,2,0,0,0,0|1,0,0]=3 10371 B16R1.1793 C=CCCC(=O)C(F)(F)Oc1ccccc1 1458a_100000749702_200000057402 [0,2,0,0,0,0|1,0,0]=3 10372 B16R1.1793 C=CCNC(=O)C(C)(C)Cc1ccccc1 1626a_100020586998_100000757416 [0,2,0,0,0,0|2,0,0]=4 10373 B16R1.1793 C=CCNC(=O)C(C)(C)Cc1ccccc1 240690a_100020586998_100000757416 [0,2,0,0,0,0|2,0,0]=4 10374 B16R1.1793 C=CCNC(=O)C(C)(C)Cc1ccccc1 527a_100020586998_100000757416 [0,2,0,0,0,0|2,0,0]=4 10375 B16R1.1793 C=CCNC(=O)C(C)(C)Oc1ccccc1 1626a_100020586998_100000743201 [0,2,0,0,0,0|1,0,0]=3 10376 B16R1.1793 C=CCNC(=O)C(C)(C)Oc1ccccc1 240690a_100020586998_100000743201 [0,2,0,0,0,0|1,0,0]=3 10377 B16R1.1793 C=CCNC(=O)C(C)(C)Oc1ccccc1 527a_100020586998_100000743201 [0,2,0,0,0,0|1,0,0]=3 10378 B16R1.1793 C=CCOC(=O)C(F)(F)Nc1ccccc1 34a_100000106764_200000069019 [0,2,0,0,0,0|1,0,0]=3 10379 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1ccccc1 34a_100000210340_200000069019 [0,2,0,0,0,0|0,0,0]=2 10380 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1ccccc1 7a_100000210340_200000069019 [0,2,0,0,0,0|0,0,0]=2 10381 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1cccnc1 34a_100000210849_200000069019 [0,2,0,0,0,0|1,0,0]=3 10382 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1cccnc1 7a_100000210849_200000069019 [0,2,0,0,0,0|1,0,0]=3 10383 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1ccncc1 34a_100000212176_200000069019 [0,2,0,0,0,0|1,0,0]=3 10384 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1ccnnc1 34a_100015204005_200000069019 [0,2,0,0,0,0|2,0,0]=4 10385 B16R1.1793 C=CCOC(=O)C(F)(F)Oc1cncnc1 7a_100000754086_200000069019 [0,2,0,0,0,0|2,0,0]=4 10386 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccccc1 62a_100000719477_200000069019 [0,2,0,0,0,0|0,1,0]=3 10387 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccccc1 62a_200000069019_100000041952 [0,2,0,0,0,0|0,1,0]=3 10388 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccccn1 62a_100011216584_200000069019 [0,2,0,0,0,0|1,1,0]=4 10389 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccccn1 62a_200000069019_100011216584 [0,2,0,0,0,0|1,1,0]=4 10390 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1cccnc1 62a_100000210063_200000069019 [0,2,0,0,0,0|1,1,0]=4 10391 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1cccnc1 62a_200000069019_100000210063 [0,2,0,0,0,0|1,1,0]=4 10392 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccncc1 62a_100000728582_200000069019 [0,2,0,0,0,0|1,1,0]=4 10393 B16R1.1793 C=CCOC(=O)C(F)(F)Sc1ccncc1 62a_200000069019_100000728582 [0,2,0,0,0,0|1,1,0]=4 10394 B16R1.1793 CC(C)(Oc1ccccc1)C(=O)OCCO 34a_100000210340_100009817195 [0,2,0,0,0,0|1,0,1]=4 10395 B16R1.1793 CC(C)(Oc1ccccc1)C(=O)OCCO 7a_100000210340_100009817195 [0,2,0,0,0,0|1,0,1]=4 10396 B16R1.7523 C=CCCC(=O)C(C)Oc1ccccc1Br 1458a_100000246065_100000754431 [0,2,0,0,0,0|1,0,0]=3 10397 B16R1.7523 C=CCCC(=O)C(C)Oc1ccccc1C 1458a_100000189243_100000754431 [0,2,0,0,0,0|1,0,0]=3 10398 B16R1.7523 C=CCCC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_100000754431 [0,2,0,0,0,0|1,0,0]=3 10399 B16R1.7523 C=CCCC(=O)C(C)Oc1ccccc1F 1458a_100000191191_100000754431 [0,2,0,0,0,0|1,0,0]=3 10400 B16R1.7523 C=CCCC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_100000754431 [0,2,0,0,0,0|1,1,0]=4 10401 B16R1.7523 C=CCCC(=O)C(O)Cc1ccccc1Br 1458a_100012382637_100000754431 [0,2,0,0,0,0|2,0,0]=4 10402 B16R1.7523 C=CCCC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_100000754431 [0,2,0,0,0,0|2,0,0]=4 10403 B16R1.7523 C=CCNC(=O)C(C)Oc1cccc[n+]1[O-] 7a_100000211761_100000230288 [0,2,0,0,0,0|2,0,0]=4 10404 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Br 1626a_100020586998_100000246065 [0,2,0,0,0,0|1,0,0]=3 10405 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Br 240690a_100020586998_100000246065 [0,2,0,0,0,0|1,0,0]=3 10406 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Br 527a_100020586998_100000246065 [0,2,0,0,0,0|1,0,0]=3 10407 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000230288 [0,2,0,0,0,0|1,0,0]=3 10408 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1C 1626a_100020586998_100000189243 [0,2,0,0,0,0|1,0,0]=3 10409 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1C 240690a_100020586998_100000189243 [0,2,0,0,0,0|1,0,0]=3 10410 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1C 527a_100020586998_100000189243 [0,2,0,0,0,0|1,0,0]=3 10411 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000230288 [0,2,0,0,0,0|1,0,0]=3 10412 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Cl 1626a_100020586998_100000191201 [0,2,0,0,0,0|1,0,0]=3 10413 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Cl 240690a_100020586998_100000191201 [0,2,0,0,0,0|1,0,0]=3 10414 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Cl 527a_100020586998_100000191201 [0,2,0,0,0,0|1,0,0]=3 10415 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000230288 [0,2,0,0,0,0|1,0,0]=3 10416 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1F 1626a_100020586998_100000191191 [0,2,0,0,0,0|1,0,0]=3 10417 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1F 240690a_100020586998_100000191191 [0,2,0,0,0,0|1,0,0]=3 10418 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1F 527a_100020586998_100000191191 [0,2,0,0,0,0|1,0,0]=3 10419 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000230288 [0,2,0,0,0,0|1,0,0]=3 10420 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000230288 [0,2,0,0,0,0|1,0,0]=3 10421 B16R1.7523 C=CCNC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000230288 [0,2,0,0,0,0|1,0,0]=3 10422 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1Br 7a_100000744436_100000230288 [0,2,0,0,0,0|2,0,0]=4 10423 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1C 7a_100000745507_100000230288 [0,2,0,0,0,0|2,0,0]=4 10424 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1Cl 7a_100000757616_100000230288 [0,2,0,0,0,0|2,0,0]=4 10425 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1F 7a_100000061740_100000230288 [0,2,0,0,0,0|2,0,0]=4 10426 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1I 7a_100000034122_100000230288 [0,2,0,0,0,0|2,0,0]=4 10427 B16R1.7523 C=CCNC(=O)C(C)Oc1cccnc1N 7a_100000211975_100000230288 [0,2,0,0,0,0|2,0,0]=4 10428 B16R1.7523 C=CCNC(=O)C(C)Oc1cccoc1=O 7a_100000077404_100000230288 [0,2,0,0,0,0|2,0,0]=4 10429 B16R1.7523 C=CCNC(=O)C(C)Oc1cnccc1C 7a_100011997053_100000230288 [0,2,0,0,0,0|2,0,0]=4 10430 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Br 62a_100000230288_100000695589 [0,2,0,0,0,0|1,1,0]=4 10431 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100000230288 [0,2,0,0,0,0|1,1,0]=4 10432 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1C 62a_100000210755_100000230288 [0,2,0,0,0,0|1,1,0]=4 10433 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1C 62a_100000230288_100000210755 [0,2,0,0,0,0|1,1,0]=4 10434 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Cl 1626a_100020586998_100000181065 [0,2,0,0,0,0|1,1,0]=4 10435 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Cl 240690a_100020586998_100000181065 [0,2,0,0,0,0|1,1,0]=4 10436 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Cl 527a_100020586998_100000181065 [0,2,0,0,0,0|1,1,0]=4 10437 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Cl 62a_100000230288_100000764095 [0,2,0,0,0,0|1,1,0]=4 10438 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000230288 [0,2,0,0,0,0|1,1,0]=4 10439 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1F 62a_100000230288_100011215700 [0,2,0,0,0,0|1,1,0]=4 10440 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1F 62a_100011215700_100000230288 [0,2,0,0,0,0|1,1,0]=4 10441 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1N 62a_100000210017_100000230288 [0,2,0,0,0,0|1,1,0]=4 10442 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1N 62a_100000230288_100000210017 [0,2,0,0,0,0|1,1,0]=4 10443 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1O 62a_100000230288_100000739446 [0,2,0,0,0,0|1,1,0]=4 10444 B16R1.7523 C=CCNC(=O)C(C)Sc1ccccc1O 62a_100000739446_100000230288 [0,2,0,0,0,0|1,1,0]=4 10445 B16R1.7523 C=CCNC(=O)C(O)Cc1ccccc1Br 240690a_100020586998_100012382637 [0,2,0,0,0,0|2,0,0]=4 10446 B16R1.7523 C=CCNC(=O)C(O)Cc1ccccc1Cl 240690a_100020586998_100000703902 [0,2,0,0,0,0|2,0,0]=4 10447 B16R1.7523 C=CCNC(=O)C(O)Cc1ccccc1Cl 527a_100020586998_100000703902 [0,2,0,0,0,0|2,0,0]=4 10448 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Br 34a_100000181306_100000760410 [0,2,0,0,0,0|0,0,2]=4 10449 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000760410 [0,2,0,0,0,0|0,0,2]=4 10450 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1C 34a_100000210338_100000760410 [0,2,0,0,0,0|0,0,2]=4 10451 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000760410 [0,2,0,0,0,0|0,0,2]=4 10452 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Cl 34a_100000210172_100000760410 [0,2,0,0,0,0|0,0,2]=4 10453 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000760410 [0,2,0,0,0,0|0,0,2]=4 10454 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1F 34a_100000210171_100000760410 [0,2,0,0,0,0|0,0,2]=4 10455 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000760410 [0,2,0,0,0,0|0,0,2]=4 10456 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1I 34a_100000739446_100000760410 [0,2,0,0,0,0|0,0,2]=4 10457 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000760410 [0,2,0,0,0,0|0,0,2]=4 10458 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1N 34a_100000185747_100000760410 [0,2,0,0,0,0|0,0,2]=4 10459 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000760410 [0,2,0,0,0,0|0,0,2]=4 10460 B16R1.7641 C=CCOC(F)(F)C(F)Oc1ccccc1 34a_100000210340_200000036644 [0,2,0,0,0,0|1,0,1]=4 10461 B16R1.853 C=CC(C)CC(=O)CCc1ccccc1Br 1458a_100011934298_100012161201 [0,2,0,0,0,0|2,0,0]=4 10462 B16R1.853 C=CC(C)CC(=O)CCc1ccccc1C 1458a_100011934298_100011713688 [0,2,0,0,0,0|2,0,0]=4 10463 B16R1.853 C=CC(C)CC(=O)CCc1ccccc1Cl 1458a_100011934298_100011713703 [0,2,0,0,0,0|2,0,0]=4 10464 B16R1.853 C=CC(C)CC(=O)CCc1ccccc1F 1458a_100011934298_100000720011 [0,2,0,0,0,0|2,0,0]=4 10465 B16R1.853 C=CC(C)CC(=O)CCc1ccccc1O 1458a_100011934298_100000722297 [0,2,0,0,0,0|2,0,0]=4 10466 B16R1.4122 CC(=O)C(C)NC(=O)COc1ccccc1 1458a_100000182740_200000210301 [0,2,0,0,0,0|1,0,1]=4 10467 B16R1.4122 CC(NC(=O)COc1ccccc1)C(=O)[13CH3] 1458a_100000182740_200025704644 [0,2,0,0,0,0|1,0,1]=4 10468 B16R1.4122 C[C@@H](NC(=O)COc1ccccc1)C(=O)N 11a_100000119354_100000186222 [0,2,0,0,0,0|2,0,0]=4 10469 B16R1.4122 C[C@@H](NC(=O)COc1ccccc1)C(=O)N 240690a_100000119354_100000186222 [0,2,0,0,0,0|2,0,0]=4 10470 B16R1.4122 C[C@@H](NC(=O)COc1ccccc1)C(=O)N 527a_100000119354_100000186222 [0,2,0,0,0,0|2,0,0]=4 10471 B16R1.7289 C=C[C@@H](CO)NC(=O)CCc1ccccc1 240690a_100016989147_100000185753 [0,2,0,0,0,0|2,0,0]=4 10472 B16R1.7289 C=C[C@@H](CO)NC(=O)CCc1ccccc1 527a_100016989147_100000185753 [0,2,0,0,0,0|2,0,0]=4 10473 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1ccccc1 240690a_100016989147_100000186222 [0,2,0,0,0,0|1,0,0]=3 10474 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1ccccc1 527a_100016989147_100000186222 [0,2,0,0,0,0|1,0,0]=3 10475 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1ccccn1 240690a_100016989147_100102699861 [0,2,0,0,0,0|2,0,0]=4 10476 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1ccccn1 527a_100016989147_100102699861 [0,2,0,0,0,0|2,0,0]=4 10477 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1cccnc1 240690a_100016989147_100015207166 [0,2,0,0,0,0|2,0,0]=4 10478 B16R1.7289 C=C[C@@H](CO)NC(=O)COc1cccnc1 527a_100016989147_100015207166 [0,2,0,0,0,0|2,0,0]=4 10479 B16R1.7289 C=C[C@@H](CO)NC(=O)CSc1ccccc1 240690a_100016989147_100000211596 [0,2,0,0,0,0|1,1,0]=4 10480 B16R1.7289 C=C[C@@H](CO)NC(=O)CSc1ccccc1 527a_100016989147_100000211596 [0,2,0,0,0,0|1,1,0]=4 10481 B16R1.10317 C=C[Si](C)(C)CC(=O)COc1ccccc1 1458a_100000186222_100000038793 [0,2,0,0,0,0|1,1,0]=4 10482 B16R1.4006 C=CCC(C)(C)C(=O)CCc1ccccc1 1458a_100000705796_100000765856 [0,2,0,0,0,0|2,0,0]=4 10483 B16R1.4006 C=CCC(F)(F)C(=O)CCc1ccccc1 1458a_100000062105_100000765856 [0,2,0,0,0,0|2,0,0]=4 10484 B16R1.4553 C=CCC(C)C(=O)CCc1ccccc1Br 1458a_100011216819_100012161201 [0,2,0,0,0,0|2,0,0]=4 10485 B16R1.4553 C=CCC(C)C(=O)CCc1ccccc1C 1458a_100011216819_100011713688 [0,2,0,0,0,0|2,0,0]=4 10486 B16R1.4553 C=CCC(C)C(=O)CCc1ccccc1Cl 1458a_100011216819_100011713703 [0,2,0,0,0,0|2,0,0]=4 10487 B16R1.4553 C=CCC(C)C(=O)CCc1ccccc1F 1458a_100011216819_100000720011 [0,2,0,0,0,0|2,0,0]=4 10488 B16R1.4553 C=CCC(C)C(=O)CCc1ccccc1O 1458a_100011216819_100000722297 [0,2,0,0,0,0|2,0,0]=4 10489 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Br 11a_100000225617_100000740810 [0,2,0,0,0,0|2,0,0]=4 10490 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Br 1626a_100000225617_100000740810 [0,2,0,0,0,0|2,0,0]=4 10491 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Br 240690a_100000225617_100000740810 [0,2,0,0,0,0|2,0,0]=4 10492 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Br 527a_100000225617_100000740810 [0,2,0,0,0,0|2,0,0]=4 10493 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1C 11a_100000225617_100000748742 [0,2,0,0,0,0|2,0,0]=4 10494 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1C 1626a_100000225617_100000748742 [0,2,0,0,0,0|2,0,0]=4 10495 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1C 240690a_100000225617_100000748742 [0,2,0,0,0,0|2,0,0]=4 10496 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1C 527a_100000225617_100000748742 [0,2,0,0,0,0|2,0,0]=4 10497 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Cl 11a_100000225617_100000184300 [0,2,0,0,0,0|2,0,0]=4 10498 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Cl 1626a_100000225617_100000184300 [0,2,0,0,0,0|2,0,0]=4 10499 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Cl 240690a_100000225617_100000184300 [0,2,0,0,0,0|2,0,0]=4 10500 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1Cl 527a_100000225617_100000184300 [0,2,0,0,0,0|2,0,0]=4 10501 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1F 11a_100000225617_100000189703 [0,2,0,0,0,0|2,0,0]=4 10502 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1F 1626a_100000225617_100000189703 [0,2,0,0,0,0|2,0,0]=4 10503 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1F 240690a_100000225617_100000189703 [0,2,0,0,0,0|2,0,0]=4 10504 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1F 527a_100000225617_100000189703 [0,2,0,0,0,0|2,0,0]=4 10505 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1I 11a_100000225617_100000037306 [0,2,0,0,0,0|2,0,0]=4 10506 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1I 1626a_100000225617_100000037306 [0,2,0,0,0,0|2,0,0]=4 10507 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1I 240690a_100000225617_100000037306 [0,2,0,0,0,0|2,0,0]=4 10508 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1I 527a_100000225617_100000037306 [0,2,0,0,0,0|2,0,0]=4 10509 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1O 11a_100000225617_100000181328 [0,2,0,0,0,0|2,0,0]=4 10510 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1O 240690a_100000225617_100000181328 [0,2,0,0,0,0|2,0,0]=4 10511 B16R1.4553 C=CCN(C)C(=O)CCc1ccccc1O 527a_100000225617_100000181328 [0,2,0,0,0,0|2,0,0]=4 10512 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Br 11a_100000225617_100000216496 [0,2,0,0,0,0|1,0,0]=3 10513 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Br 1626a_100000225617_100000216496 [0,2,0,0,0,0|1,0,0]=3 10514 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Br 240690a_100000225617_100000216496 [0,2,0,0,0,0|1,0,0]=3 10515 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Br 527a_100000225617_100000216496 [0,2,0,0,0,0|1,0,0]=3 10516 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1C 11a_100000225617_100000182418 [0,2,0,0,0,0|1,0,0]=3 10517 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1C 1626a_100000225617_100000182418 [0,2,0,0,0,0|1,0,0]=3 10518 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1C 240690a_100000225617_100000182418 [0,2,0,0,0,0|1,0,0]=3 10519 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1C 527a_100000225617_100000182418 [0,2,0,0,0,0|1,0,0]=3 10520 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Cl 11a_100000225617_100000185159 [0,2,0,0,0,0|1,0,0]=3 10521 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Cl 1626a_100000225617_100000185159 [0,2,0,0,0,0|1,0,0]=3 10522 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Cl 240690a_100000225617_100000185159 [0,2,0,0,0,0|1,0,0]=3 10523 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1Cl 527a_100000225617_100000185159 [0,2,0,0,0,0|1,0,0]=3 10524 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1F 11a_100000225617_100000182486 [0,2,0,0,0,0|1,0,0]=3 10525 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1F 1626a_100000225617_100000182486 [0,2,0,0,0,0|1,0,0]=3 10526 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1F 240690a_100000225617_100000182486 [0,2,0,0,0,0|1,0,0]=3 10527 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1F 527a_100000225617_100000182486 [0,2,0,0,0,0|1,0,0]=3 10528 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1O 240690a_100000225617_100000183020 [0,2,0,0,0,0|1,0,0]=3 10529 B16R1.4553 C=CCN(C)C(=O)COc1ccccc1O 527a_100000225617_100000183020 [0,2,0,0,0,0|1,0,0]=3 10530 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1C 11a_100000225617_100000183026 [0,2,0,0,0,0|1,1,0]=4 10531 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1C 1626a_100000225617_100000183026 [0,2,0,0,0,0|1,1,0]=4 10532 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1C 240690a_100000225617_100000183026 [0,2,0,0,0,0|1,1,0]=4 10533 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1C 527a_100000225617_100000183026 [0,2,0,0,0,0|1,1,0]=4 10534 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1F 11a_100000225617_100000179528 [0,2,0,0,0,0|1,1,0]=4 10535 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1F 1626a_100000225617_100000179528 [0,2,0,0,0,0|1,1,0]=4 10536 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1F 240690a_100000225617_100000179528 [0,2,0,0,0,0|1,1,0]=4 10537 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1O 240690a_100000225617_100000695322 [0,2,0,0,0,0|1,1,0]=4 10538 B16R1.4553 C=CCN(C)C(=O)CSc1ccccc1O 527a_100000225617_100000695322 [0,2,0,0,0,0|1,1,0]=4 10539 B16R1.6944 C=C(C)CN(C)C(=O)CCc1ccccc1 11a_100000225649_100000185753 [0,2,0,0,0,0|2,0,0]=4 10540 B16R1.6944 C=C(C)CN(C)C(=O)CCc1ccccc1 1626a_100000225649_100000185753 [0,2,0,0,0,0|2,0,0]=4 10541 B16R1.6944 C=C(C)CN(C)C(=O)CCc1ccccc1 527a_100000225649_100000185753 [0,2,0,0,0,0|2,0,0]=4 10542 B16R1.6944 C=C(C)CN(C)C(=O)COc1ccccc1 11a_100000225649_100000186222 [0,2,0,0,0,0|1,0,0]=3 10543 B16R1.6944 C=C(C)CN(C)C(=O)COc1ccccc1 1626a_100000225649_100000186222 [0,2,0,0,0,0|1,0,0]=3 10544 B16R1.6944 C=C(C)CN(C)C(=O)COc1ccccc1 527a_100000225649_100000186222 [0,2,0,0,0,0|1,0,0]=3 10545 B16R1.6944 C=C(C)CN(C)C(=O)COc1ccccn1 1626a_100000225649_100102699861 [0,2,0,0,0,0|2,0,0]=4 10546 B16R1.6944 C=C(C)CN(C)C(=O)COc1ccccn1 527a_100000225649_100102699861 [0,2,0,0,0,0|2,0,0]=4 10547 B16R1.6944 C=C(C)CN(C)C(=O)COc1cccnc1 11a_100000225649_100015207166 [0,2,0,0,0,0|2,0,0]=4 10548 B16R1.6944 C=C(C)CN(C)C(=O)COc1cccnc1 1626a_100000225649_100015207166 [0,2,0,0,0,0|2,0,0]=4 10549 B16R1.6944 C=C(C)CN(C)C(=O)COc1cccnc1 527a_100000225649_100015207166 [0,2,0,0,0,0|2,0,0]=4 10550 B16R1.6944 C=C(C)CN(C)C(=O)CSc1ccccc1 11a_100000225649_100000211596 [0,2,0,0,0,0|1,1,0]=4 10551 B16R1.6944 C=C(C)CN(C)C(=O)CSc1ccccc1 1626a_100000225649_100000211596 [0,2,0,0,0,0|1,1,0]=4 10552 B16R1.6944 C=C(C)CN(C)C(=O)CSc1ccccc1 527a_100000225649_100000211596 [0,2,0,0,0,0|1,1,0]=4 10553 B16R1.6944 CN(CC(=O)N)C(=O)COc1ccccc1 11a_100000739694_100000186222 [0,2,0,0,0,0|2,0,0]=4 10554 B16R1.6944 CN(CC(=O)N)C(=O)COc1ccccc1 527a_100000739694_100000186222 [0,2,0,0,0,0|2,0,0]=4 10555 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1Br 1458a_100000740810_100000730704 [0,2,0,0,0,0|2,0,0]=4 10556 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1Br 1458a_200000688413_100012161201 [0,2,0,0,0,0|2,0,0]=4 10557 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1C 1458a_100000748742_100000730704 [0,2,0,0,0,0|2,0,0]=4 10558 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1C 1458a_200000688413_100011713688 [0,2,0,0,0,0|2,0,0]=4 10559 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000730704 [0,2,0,0,0,0|2,0,0]=4 10560 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1Cl 1458a_200000688413_100011713703 [0,2,0,0,0,0|2,0,0]=4 10561 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1F 1458a_100000189703_100000730704 [0,2,0,0,0,0|2,0,0]=4 10562 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1F 1458a_200000688413_100000720011 [0,2,0,0,0,0|2,0,0]=4 10563 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1I 1458a_100000037306_100000730704 [0,2,0,0,0,0|2,0,0]=4 10564 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1O 1458a_100000181328_100000730704 [0,2,0,0,0,0|2,0,0]=4 10565 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1O 1458a_200000688413_100000722297 [0,2,0,0,0,0|2,0,0]=4 10566 B16R1.400 C=C(C)CCC(=O)COc1ccccc1Br 1458a_100000216496_100000730704 [0,2,0,0,0,0|1,0,0]=3 10567 B16R1.400 C=C(C)CCC(=O)COc1ccccc1C 1458a_100000182418_100000730704 [0,2,0,0,0,0|1,0,0]=3 10568 B16R1.400 C=C(C)CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000730704 [0,2,0,0,0,0|1,0,0]=3 10569 B16R1.400 C=C(C)CCC(=O)COc1ccccc1F 1458a_100000182486_100000730704 [0,2,0,0,0,0|1,0,0]=3 10570 B16R1.400 C=C(C)CCC(=O)COc1ccccc1O 1458a_100000183020_100000730704 [0,2,0,0,0,0|1,0,0]=3 10571 B16R1.400 C=C(C)CCC(=O)CSc1ccccc1C 1458a_100000183026_100000730704 [0,2,0,0,0,0|1,1,0]=4 10572 B16R1.400 C=C(C)CCC(=O)CSc1ccccc1F 1458a_100000179528_100000730704 [0,2,0,0,0,0|1,1,0]=4 10573 B16R1.400 C=C(C)CCC(=O)CSc1ccccc1O 1458a_100000695322_100000730704 [0,2,0,0,0,0|1,1,0]=4 10574 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Br 11a_100000765925_100000740810 [0,2,0,0,0,0|2,0,0]=4 10575 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Br 1626a_100000765925_100000740810 [0,2,0,0,0,0|2,0,0]=4 10576 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Br 240690a_100000765925_100000740810 [0,2,0,0,0,0|2,0,0]=4 10577 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Br 527a_100000765925_100000740810 [0,2,0,0,0,0|2,0,0]=4 10578 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1C 11a_100000765925_100000748742 [0,2,0,0,0,0|2,0,0]=4 10579 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1C 1626a_100000765925_100000748742 [0,2,0,0,0,0|2,0,0]=4 10580 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1C 240690a_100000765925_100000748742 [0,2,0,0,0,0|2,0,0]=4 10581 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1C 527a_100000765925_100000748742 [0,2,0,0,0,0|2,0,0]=4 10582 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Cl 11a_100000765925_100000184300 [0,2,0,0,0,0|2,0,0]=4 10583 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Cl 1626a_100000765925_100000184300 [0,2,0,0,0,0|2,0,0]=4 10584 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Cl 240690a_100000765925_100000184300 [0,2,0,0,0,0|2,0,0]=4 10585 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1Cl 527a_100000765925_100000184300 [0,2,0,0,0,0|2,0,0]=4 10586 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1F 11a_100000765925_100000189703 [0,2,0,0,0,0|2,0,0]=4 10587 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1F 1626a_100000765925_100000189703 [0,2,0,0,0,0|2,0,0]=4 10588 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1F 240690a_100000765925_100000189703 [0,2,0,0,0,0|2,0,0]=4 10589 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1F 527a_100000765925_100000189703 [0,2,0,0,0,0|2,0,0]=4 10590 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1I 11a_100000765925_100000037306 [0,2,0,0,0,0|2,0,0]=4 10591 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1I 1626a_100000765925_100000037306 [0,2,0,0,0,0|2,0,0]=4 10592 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1I 240690a_100000765925_100000037306 [0,2,0,0,0,0|2,0,0]=4 10593 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1I 527a_100000765925_100000037306 [0,2,0,0,0,0|2,0,0]=4 10594 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1O 11a_100000765925_100000181328 [0,2,0,0,0,0|2,0,0]=4 10595 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1O 240690a_100000765925_100000181328 [0,2,0,0,0,0|2,0,0]=4 10596 B16R1.400 C=C(C)CNC(=O)CCc1ccccc1O 527a_100000765925_100000181328 [0,2,0,0,0,0|2,0,0]=4 10597 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Br 11a_100000765925_100000216496 [0,2,0,0,0,0|1,0,0]=3 10598 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Br 1626a_100000765925_100000216496 [0,2,0,0,0,0|1,0,0]=3 10599 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Br 240690a_100000765925_100000216496 [0,2,0,0,0,0|1,0,0]=3 10600 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Br 527a_100000765925_100000216496 [0,2,0,0,0,0|1,0,0]=3 10601 B16R1.400 C=C(C)CNC(=O)COc1ccccc1C 11a_100000765925_100000182418 [0,2,0,0,0,0|1,0,0]=3 10602 B16R1.400 C=C(C)CNC(=O)COc1ccccc1C 1626a_100000765925_100000182418 [0,2,0,0,0,0|1,0,0]=3 10603 B16R1.400 C=C(C)CNC(=O)COc1ccccc1C 240690a_100000765925_100000182418 [0,2,0,0,0,0|1,0,0]=3 10604 B16R1.400 C=C(C)CNC(=O)COc1ccccc1C 527a_100000765925_100000182418 [0,2,0,0,0,0|1,0,0]=3 10605 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Cl 11a_100000765925_100000185159 [0,2,0,0,0,0|1,0,0]=3 10606 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Cl 1626a_100000765925_100000185159 [0,2,0,0,0,0|1,0,0]=3 10607 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Cl 240690a_100000765925_100000185159 [0,2,0,0,0,0|1,0,0]=3 10608 B16R1.400 C=C(C)CNC(=O)COc1ccccc1Cl 527a_100000765925_100000185159 [0,2,0,0,0,0|1,0,0]=3 10609 B16R1.400 C=C(C)CNC(=O)COc1ccccc1F 11a_100000765925_100000182486 [0,2,0,0,0,0|1,0,0]=3 10610 B16R1.400 C=C(C)CNC(=O)COc1ccccc1F 1626a_100000765925_100000182486 [0,2,0,0,0,0|1,0,0]=3 10611 B16R1.400 C=C(C)CNC(=O)COc1ccccc1F 240690a_100000765925_100000182486 [0,2,0,0,0,0|1,0,0]=3 10612 B16R1.400 C=C(C)CNC(=O)COc1ccccc1F 527a_100000765925_100000182486 [0,2,0,0,0,0|1,0,0]=3 10613 B16R1.400 C=C(C)CNC(=O)COc1ccccc1O 240690a_100000765925_100000183020 [0,2,0,0,0,0|1,0,0]=3 10614 B16R1.400 C=C(C)CNC(=O)COc1ccccc1O 527a_100000765925_100000183020 [0,2,0,0,0,0|1,0,0]=3 10615 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1C 11a_100000765925_100000183026 [0,2,0,0,0,0|1,1,0]=4 10616 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1C 1626a_100000765925_100000183026 [0,2,0,0,0,0|1,1,0]=4 10617 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1C 240690a_100000765925_100000183026 [0,2,0,0,0,0|1,1,0]=4 10618 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1C 527a_100000765925_100000183026 [0,2,0,0,0,0|1,1,0]=4 10619 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1F 11a_100000765925_100000179528 [0,2,0,0,0,0|1,1,0]=4 10620 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1F 1626a_100000765925_100000179528 [0,2,0,0,0,0|1,1,0]=4 10621 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1F 240690a_100000765925_100000179528 [0,2,0,0,0,0|1,1,0]=4 10622 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1O 240690a_100000765925_100000695322 [0,2,0,0,0,0|1,1,0]=4 10623 B16R1.400 C=C(C)CNC(=O)CSc1ccccc1O 527a_100000765925_100000695322 [0,2,0,0,0,0|1,1,0]=4 10624 B16R1.400 C=C(C)COC(C)COc1ccccc1C 34a_200011217337_100000748629 [0,2,0,0,0,0|1,0,1]=4 10625 B16R1.400 C=C(C)COC(C)COc1ccccc1C 7a_200011217337_100000748629 [0,2,0,0,0,0|1,0,1]=4 10626 B16R1.400 C=C(F)COC(C)COc1ccccc1C 34a_200011217337_100009893438 [0,2,0,0,0,0|1,0,1]=4 10627 B16R1.400 C=C(F)COC(C)COc1ccccc1C 7a_200011217337_100000042424 [0,2,0,0,0,0|1,0,1]=4 10628 B16R1.400 Cc1ccccc1OCC(=O)NCC(=O)N 11a_100000711301_100000182418 [0,2,0,0,0,0|2,0,0]=4 10629 B16R1.400 Cc1ccccc1OCC(=O)NCC(=O)N 240690a_100000711301_100000182418 [0,2,0,0,0,0|2,0,0]=4 10630 B16R1.400 Cc1ccccc1OCC(=O)NCC(=O)N 527a_100000711301_100000182418 [0,2,0,0,0,0|2,0,0]=4 10631 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Br 11a_100000711301_100000216496 [0,2,0,0,0,0|2,0,0]=4 10632 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Br 240690a_100000711301_100000216496 [0,2,0,0,0,0|2,0,0]=4 10633 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Br 527a_100000711301_100000216496 [0,2,0,0,0,0|2,0,0]=4 10634 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Cl 11a_100000711301_100000185159 [0,2,0,0,0,0|2,0,0]=4 10635 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Cl 240690a_100000711301_100000185159 [0,2,0,0,0,0|2,0,0]=4 10636 B16R1.400 NC(=O)CNC(=O)COc1ccccc1Cl 527a_100000711301_100000185159 [0,2,0,0,0,0|2,0,0]=4 10637 B16R1.400 NC(=O)CNC(=O)COc1ccccc1F 11a_100000711301_100000182486 [0,2,0,0,0,0|2,0,0]=4 10638 B16R1.400 NC(=O)CNC(=O)COc1ccccc1F 240690a_100000711301_100000182486 [0,2,0,0,0,0|2,0,0]=4 10639 B16R1.400 NC(=O)CNC(=O)COc1ccccc1F 527a_100000711301_100000182486 [0,2,0,0,0,0|2,0,0]=4 10640 B16R1.400 NC(=O)CNC(=O)COc1ccccc1O 240690a_100000711301_100000183020 [0,2,0,0,0,0|2,0,0]=4 10641 B16R1.400 NC(=O)CNC(=O)COc1ccccc1O 527a_100000711301_100000183020 [0,2,0,0,0,0|2,0,0]=4 10642 B16R1.1454 C#Cc1ccccc1NCC(=O)OCC=C 34a_100011470550_100000033060 [0,2,0,0,0,0|1,0,0]=3 10643 B16R1.1454 C#Cc1ccccc1OCC(=O)NCC=C 7a_200011470546_100000183597 [0,2,0,0,0,0|1,0,0]=3 10644 B16R1.1454 C#Cc1ccccc1OCC(=O)OCC=C 34a_200011470546_100000033060 [0,2,0,0,0,0|0,0,0]=2 10645 B16R1.1454 C#Cc1ccccc1OCC(=O)OCC=C 7a_200011470546_100000033060 [0,2,0,0,0,0|0,0,0]=2 10646 B16R1.1454 C#Cc1ccccc1OCC(=O)OCCC 34a_200011470546_200011215008 [0,2,0,0,0,0|0,0,2]=4 10647 B16R1.1454 C#Cc1ccccc1OCC(=O)OCCC 7a_200011470546_200011215008 [0,2,0,0,0,0|0,0,2]=4 10648 B16R1.1454 C=CCCC(=O)CCc1ccccc1C#N 1458a_100000025266_100000754431 [0,2,0,0,0,0|2,0,0]=4 10649 B16R1.1454 C=CCCC(=O)CCc1ccccc1C#N 1458a_100000749702_200013032965 [0,2,0,0,0,0|2,0,0]=4 10650 B16R1.1454 C=CCCC(=O)CCc1ccccc1C=O 1458a_100000749702_100010186698 [0,2,0,0,0,0|2,0,0]=4 10651 B16R1.1454 C=CCCC(=O)CCc1ccccc1OC 1458a_100000184355_100000754431 [0,2,0,0,0,0|2,0,0]=4 10652 B16R1.1454 C=CCCC(=O)CCc1ccccc1OC 1458a_100000749702_100011713687 [0,2,0,0,0,0|2,0,0]=4 10653 B16R1.1454 C=CCCC(=O)COc1ccccc1C#N 1458a_100000182527_100000754431 [0,2,0,0,0,0|1,0,0]=3 10654 B16R1.1454 C=CCCC(=O)COc1ccccc1CC 1458a_100000182566_100000754431 [0,2,0,0,0,0|1,0,0]=3 10655 B16R1.1454 C=CCCC(=O)COc1ccccc1CO 1458a_200011894254_100000754431 [0,2,0,0,0,0|1,0,0]=3 10656 B16R1.1454 C=CCCC(=O)COc1ccccc1OC 1458a_100000182946_100000754431 [0,2,0,0,0,0|1,0,0]=3 10657 B16R1.1454 C=CCNC(=O)CCc1ccccc1C#N 1626a_100020586998_100000025266 [0,2,0,0,0,0|2,0,0]=4 10658 B16R1.1454 C=CCNC(=O)CCc1ccccc1C#N 240690a_100020586998_100000025266 [0,2,0,0,0,0|2,0,0]=4 10659 B16R1.1454 C=CCNC(=O)CCc1ccccc1C#N 527a_100020586998_100000025266 [0,2,0,0,0,0|2,0,0]=4 10660 B16R1.1454 C=CCNC(=O)CCc1ccccc1OC 1626a_100020586998_100000184355 [0,2,0,0,0,0|2,0,0]=4 10661 B16R1.1454 C=CCNC(=O)CCc1ccccc1OC 240690a_100020586998_100000184355 [0,2,0,0,0,0|2,0,0]=4 10662 B16R1.1454 C=CCNC(=O)CCc1ccccc1OC 527a_100020586998_100000184355 [0,2,0,0,0,0|2,0,0]=4 10663 B16R1.1454 C=CCNC(=O)CNc1ccccc1CC 2230a_100000212081_100000183597 [0,2,0,0,0,0|2,0,0]=4 10664 B16R1.1454 C=CCNC(=O)CNc1ccccc1CC 7a_100000212081_100000183597 [0,2,0,0,0,0|2,0,0]=4 10665 B16R1.1454 C=CCNC(=O)COc1ccccc1C#N 1626a_100020586998_100000182527 [0,2,0,0,0,0|1,0,0]=3 10666 B16R1.1454 C=CCNC(=O)COc1ccccc1C#N 240690a_100020586998_100000182527 [0,2,0,0,0,0|1,0,0]=3 10667 B16R1.1454 C=CCNC(=O)COc1ccccc1C#N 527a_100020586998_100000182527 [0,2,0,0,0,0|1,0,0]=3 10668 B16R1.1454 C=CCNC(=O)COc1ccccc1C#N 7a_100000211048_100000183597 [0,2,0,0,0,0|1,0,0]=3 10669 B16R1.1454 C=CCNC(=O)COc1ccccc1CC 1626a_100020586998_100000182566 [0,2,0,0,0,0|1,0,0]=3 10670 B16R1.1454 C=CCNC(=O)COc1ccccc1CC 240690a_100020586998_100000182566 [0,2,0,0,0,0|1,0,0]=3 10671 B16R1.1454 C=CCNC(=O)COc1ccccc1CC 527a_100020586998_100000182566 [0,2,0,0,0,0|1,0,0]=3 10672 B16R1.1454 C=CCNC(=O)COc1ccccc1CC 7a_100000210936_100000183597 [0,2,0,0,0,0|1,0,0]=3 10673 B16R1.1454 C=CCNC(=O)COc1ccccc1CO 240690a_100020586998_200011894254 [0,2,0,0,0,0|1,0,0]=3 10674 B16R1.1454 C=CCNC(=O)COc1ccccc1OC 1626a_100020586998_100000182946 [0,2,0,0,0,0|1,0,0]=3 10675 B16R1.1454 C=CCNC(=O)COc1ccccc1OC 240690a_100020586998_100000182946 [0,2,0,0,0,0|1,0,0]=3 10676 B16R1.1454 C=CCNC(=O)COc1ccccc1OC 527a_100020586998_100000182946 [0,2,0,0,0,0|1,0,0]=3 10677 B16R1.1454 C=CCNC(=O)COc1cccnc1C#N 7a_100000722750_100000183597 [0,2,0,0,0,0|2,0,0]=4 10678 B16R1.1454 C=CCNC(=O)COc1cccnc1CBr 7a_200020655725_100000183597 [0,2,0,0,0,0|2,0,0]=4 10679 B16R1.1454 C=CCNC(=O)COc1cccnc1OC 7a_100000698397_100000183597 [0,2,0,0,0,0|2,0,0]=4 10680 B16R1.1454 C=CCNC(=O)COc1cnccc1C#N 7a_100012181322_100000183597 [0,2,0,0,0,0|2,0,0]=4 10681 B16R1.1454 C=CCNC(=O)CSc1ccccc1C#N 62a_100000183597_100000188569 [0,2,0,0,0,0|1,1,0]=4 10682 B16R1.1454 C=CCNC(=O)CSc1ccccc1C=C 62a_100000183597_100011218376 [0,2,0,0,0,0|1,1,0]=4 10683 B16R1.1454 C=CCNC(=O)CSc1ccccc1C=C 62a_100011218376_100000183597 [0,2,0,0,0,0|1,1,0]=4 10684 B16R1.1454 C=CCNC(=O)CSc1ccccc1C=O 62a_100000183597_100000210073 [0,2,0,0,0,0|1,1,0]=4 10685 B16R1.1454 C=CCNC(=O)CSc1ccccc1C=O 62a_100000210073_100000183597 [0,2,0,0,0,0|1,1,0]=4 10686 B16R1.1454 C=CCNC(=O)CSc1ccccc1CC 62a_100000183597_100011215823 [0,2,0,0,0,0|1,1,0]=4 10687 B16R1.1454 C=CCNC(=O)CSc1ccccc1CC 62a_100011215823_100000183597 [0,2,0,0,0,0|1,1,0]=4 10688 B16R1.1454 C=CCNC(=O)CSc1ccccc1CN 62a_100000183597_100000689332 [0,2,0,0,0,0|1,1,0]=4 10689 B16R1.1454 C=CCNC(=O)CSc1ccccc1CN 62a_100000689332_100000183597 [0,2,0,0,0,0|1,1,0]=4 10690 B16R1.1454 C=CCNC(=O)CSc1ccccc1CO 62a_100000183597_100000187465 [0,2,0,0,0,0|1,1,0]=4 10691 B16R1.1454 C=CCNC(=O)CSc1ccccc1CO 62a_100000187465_100000183597 [0,2,0,0,0,0|1,1,0]=4 10692 B16R1.1454 C=CCNC(=O)CSc1ccccc1NC 62a_100000183597_100020606079 [0,2,0,0,0,0|1,1,0]=4 10693 B16R1.1454 C=CCNC(=O)CSc1ccccc1NC 62a_100020606079_100000183597 [0,2,0,0,0,0|1,1,0]=4 10694 B16R1.1454 C=CCNC(=O)CSc1ccccc1NN 62a_100000183597_100000241748 [0,2,0,0,0,0|1,1,0]=4 10695 B16R1.1454 C=CCNC(=O)CSc1ccccc1NN 62a_100000241748_100000183597 [0,2,0,0,0,0|1,1,0]=4 10696 B16R1.1454 C=CCNC(=O)CSc1ccccc1OC 62a_100000183597_100000210334 [0,2,0,0,0,0|1,1,0]=4 10697 B16R1.1454 C=CCNC(=O)CSc1ccccc1OC 62a_100000210334_100000183597 [0,2,0,0,0,0|1,1,0]=4 10698 B16R1.1454 C=CCNC(=O)CSc1ccccc1SC 62a_100000183597_100011217816 [0,2,0,0,0,0|1,1,0]=4 10699 B16R1.1454 C=CCNC(=O)CSc1ccccc1SC 62a_100011217816_100000183597 [0,2,0,0,0,0|1,1,0]=4 10700 B16R1.1454 C=CCOC(=O)CNc1ccccc1C#N 34a_100000211148_100000033060 [0,2,0,0,0,0|1,0,0]=3 10701 B16R1.1454 C=CCOC(=O)CNc1ccccc1C=C 34a_100012022501_100000033060 [0,2,0,0,0,0|1,0,0]=3 10702 B16R1.1454 C=CCOC(=O)CNc1ccccc1CC 2230a_100000212081_100000033060 [0,2,0,0,0,0|1,0,0]=3 10703 B16R1.1454 C=CCOC(=O)CNc1ccccc1CC 34a_100000212081_100000033060 [0,2,0,0,0,0|1,0,0]=3 10704 B16R1.1454 C=CCOC(=O)CNc1ccccc1CC 7a_100000212081_100000033060 [0,2,0,0,0,0|1,0,0]=3 10705 B16R1.1454 C=CCOC(=O)CNc1ccccc1CO 34a_100000212039_100000033060 [0,2,0,0,0,0|1,0,0]=3 10706 B16R1.1454 C=CCOC(=O)CNc1ccccc1OC 34a_100000210025_100000033060 [0,2,0,0,0,0|1,0,0]=3 10707 B16R1.1454 C=CCOC(=O)CNc1ccccc1SC 34a_100000211160_100000033060 [0,2,0,0,0,0|1,0,0]=3 10708 B16R1.1454 C=CCOC(=O)COc1ccccc1C#N 34a_100000211048_100000033060 [0,2,0,0,0,0|0,0,0]=2 10709 B16R1.1454 C=CCOC(=O)COc1ccccc1C#N 7a_100000211048_100000033060 [0,2,0,0,0,0|0,0,0]=2 10710 B16R1.1454 C=CCOC(=O)COc1ccccc1CC 34a_100000210936_100000033060 [0,2,0,0,0,0|0,0,0]=2 10711 B16R1.1454 C=CCOC(=O)COc1ccccc1CC 7a_100000210936_100000033060 [0,2,0,0,0,0|0,0,0]=2 10712 B16R1.1454 C=CCOC(=O)COc1ccccc1CN 34a_100000185550_100000033060 [0,2,0,0,0,0|0,0,0]=2 10713 B16R1.1454 C=CCOC(=O)COc1ccccc1CO 34a_100011216872_100000033060 [0,2,0,0,0,0|0,0,0]=2 10714 B16R1.1454 C=CCOC(=O)COc1ccccc1NC 34a_100000033821_100000033060 [0,2,0,0,0,0|0,0,0]=2 10715 B16R1.1454 C=CCOC(=O)COc1ccccc1OC 34a_100000210385_100000033060 [0,2,0,0,0,0|0,0,0]=2 10716 B16R1.1454 C=CCOC(=O)COc1ccccc1SC 34a_100011216402_100000033060 [0,2,0,0,0,0|0,0,0]=2 10717 B16R1.1454 C=CCOC(=O)COc1cccnc1C#N 34a_100000722750_100000033060 [0,2,0,0,0,0|1,0,0]=3 10718 B16R1.1454 C=CCOC(=O)COc1cccnc1C#N 7a_100000722750_100000033060 [0,2,0,0,0,0|1,0,0]=3 10719 B16R1.1454 C=CCOC(=O)COc1cccnc1CBr 34a_200020655725_100000033060 [0,2,0,0,0,0|1,0,0]=3 10720 B16R1.1454 C=CCOC(=O)COc1cccnc1CBr 7a_200020655725_100000033060 [0,2,0,0,0,0|1,0,0]=3 10721 B16R1.1454 C=CCOC(=O)COc1cccnc1CO 34a_100000731849_100000033060 [0,2,0,0,0,0|1,0,0]=3 10722 B16R1.1454 C=CCOC(=O)COc1cccnc1OC 34a_100000698397_100000033060 [0,2,0,0,0,0|1,0,0]=3 10723 B16R1.1454 C=CCOC(=O)COc1cccnc1OC 7a_100000698397_100000033060 [0,2,0,0,0,0|1,0,0]=3 10724 B16R1.1454 C=CCOC(=O)COc1cnccc1C#N 7a_100012181322_100000033060 [0,2,0,0,0,0|1,0,0]=3 10725 B16R1.1454 C=CCOC(=O)COc1cnccc1CO 34a_100000078615_100000033060 [0,2,0,0,0,0|1,0,0]=3 10726 B16R1.1454 C=CCOC(=O)COc1cnccc1OC 34a_100000101186_100000033060 [0,2,0,0,0,0|1,0,0]=3 10727 B16R1.1454 C=CCOC(=O)COc1ncccc1OC 34a_100025773188_100000033060 [0,2,0,0,0,0|1,0,0]=3 10728 B16R1.1454 C=CCOC(=O)CSc1ccccc1C#N 62a_100000033060_100000188569 [0,2,0,0,0,0|0,1,0]=3 10729 B16R1.1454 C=CCOC(=O)CSc1ccccc1C=C 62a_100000033060_100011218376 [0,2,0,0,0,0|0,1,0]=3 10730 B16R1.1454 C=CCOC(=O)CSc1ccccc1C=C 62a_100011218376_100000033060 [0,2,0,0,0,0|0,1,0]=3 10731 B16R1.1454 C=CCOC(=O)CSc1ccccc1C=O 62a_100000033060_100000210073 [0,2,0,0,0,0|0,1,0]=3 10732 B16R1.1454 C=CCOC(=O)CSc1ccccc1C=O 62a_100000210073_100000033060 [0,2,0,0,0,0|0,1,0]=3 10733 B16R1.1454 C=CCOC(=O)CSc1ccccc1CC 62a_100000033060_100011215823 [0,2,0,0,0,0|0,1,0]=3 10734 B16R1.1454 C=CCOC(=O)CSc1ccccc1CC 62a_100011215823_100000033060 [0,2,0,0,0,0|0,1,0]=3 10735 B16R1.1454 C=CCOC(=O)CSc1ccccc1CN 62a_100000033060_100000689332 [0,2,0,0,0,0|0,1,0]=3 10736 B16R1.1454 C=CCOC(=O)CSc1ccccc1CN 62a_100000689332_100000033060 [0,2,0,0,0,0|0,1,0]=3 10737 B16R1.1454 C=CCOC(=O)CSc1ccccc1CO 62a_100000033060_100000187465 [0,2,0,0,0,0|0,1,0]=3 10738 B16R1.1454 C=CCOC(=O)CSc1ccccc1CO 62a_100000187465_100000033060 [0,2,0,0,0,0|0,1,0]=3 10739 B16R1.1454 C=CCOC(=O)CSc1ccccc1NC 62a_100000033060_100020606079 [0,2,0,0,0,0|0,1,0]=3 10740 B16R1.1454 C=CCOC(=O)CSc1ccccc1NC 62a_100020606079_100000033060 [0,2,0,0,0,0|0,1,0]=3 10741 B16R1.1454 C=CCOC(=O)CSc1ccccc1NN 62a_100000033060_100000241748 [0,2,0,0,0,0|0,1,0]=3 10742 B16R1.1454 C=CCOC(=O)CSc1ccccc1NN 62a_100000241748_100000033060 [0,2,0,0,0,0|0,1,0]=3 10743 B16R1.1454 C=CCOC(=O)CSc1ccccc1OC 62a_100000033060_100000210334 [0,2,0,0,0,0|0,1,0]=3 10744 B16R1.1454 C=CCOC(=O)CSc1ccccc1OC 62a_100000210334_100000033060 [0,2,0,0,0,0|0,1,0]=3 10745 B16R1.1454 C=CCOC(=O)CSc1ccccc1SC 62a_100000033060_100011217816 [0,2,0,0,0,0|0,1,0]=3 10746 B16R1.1454 C=CCOC(=O)CSc1ccccc1SC 62a_100011217816_100000033060 [0,2,0,0,0,0|0,1,0]=3 10747 B16R1.1454 C=CCOC(=O)CSc1cccnc1C#N 62a_100000033060_100000685805 [0,2,0,0,0,0|1,1,0]=4 10748 B16R1.1454 C=CCOC(=O)CSc1cccnc1C=O 62a_100000033060_100011934733 [0,2,0,0,0,0|1,1,0]=4 10749 B16R1.1454 C=CCOC(=O)CSc1cccnc1C=O 62a_100011934733_100000033060 [0,2,0,0,0,0|1,1,0]=4 10750 B16R1.1454 C=CCOC(=O)CSc1cccnc1CC 62a_100000033060_100009877225 [0,2,0,0,0,0|1,1,0]=4 10751 B16R1.1454 C=CCOC(=O)CSc1cccnc1CC 62a_100009877225_100000033060 [0,2,0,0,0,0|1,1,0]=4 10752 B16R1.1454 C=CCOC(=O)CSc1cccnc1CN 62a_100000033060_100020591323 [0,2,0,0,0,0|1,1,0]=4 10753 B16R1.1454 C=CCOC(=O)CSc1cccnc1CN 62a_100020591323_100000033060 [0,2,0,0,0,0|1,1,0]=4 10754 B16R1.1454 C=CCOC(=O)CSc1cccnc1CO 62a_100000033060_100011996772 [0,2,0,0,0,0|1,1,0]=4 10755 B16R1.1454 C=CCOC(=O)CSc1cccnc1CO 62a_100011996772_100000033060 [0,2,0,0,0,0|1,1,0]=4 10756 B16R1.1454 C=CCOC(=O)CSc1cccnc1NC 62a_100000033060_100000700899 [0,2,0,0,0,0|1,1,0]=4 10757 B16R1.1454 C=CCOC(=O)CSc1cccnc1NC 62a_100000700899_100000033060 [0,2,0,0,0,0|1,1,0]=4 10758 B16R1.1454 C=CCOC(=O)CSc1cccnc1NN 62a_100000033060_100011464834 [0,2,0,0,0,0|1,1,0]=4 10759 B16R1.1454 C=CCOC(=O)CSc1cccnc1NN 62a_100011464834_100000033060 [0,2,0,0,0,0|1,1,0]=4 10760 B16R1.1454 C=CCOC(=O)CSc1cccnc1OC 62a_100000033060_100000047025 [0,2,0,0,0,0|1,1,0]=4 10761 B16R1.1454 C=CCOC(=O)CSc1cccnc1OC 62a_100000047025_100000033060 [0,2,0,0,0,0|1,1,0]=4 10762 B16R1.1454 C=CCOC(=O)CSc1cccnc1SC 62a_100000033060_100011465278 [0,2,0,0,0,0|1,1,0]=4 10763 B16R1.1454 C=CCOC(=O)CSc1cccnc1SC 62a_100011465278_100000033060 [0,2,0,0,0,0|1,1,0]=4 10764 B16R1.1454 C=CCOC(=O)CSc1ccncc1C#N 62a_100000033060_100000687039 [0,2,0,0,0,0|1,1,0]=4 10765 B16R1.1454 C=CCOC(=O)CSc1ccncc1C=O 62a_100000033060_100000050567 [0,2,0,0,0,0|1,1,0]=4 10766 B16R1.1454 C=CCOC(=O)CSc1ccncc1C=O 62a_100000050567_100000033060 [0,2,0,0,0,0|1,1,0]=4 10767 B16R1.1454 C=CCOC(=O)CSc1ccncc1CC 62a_100000033060_100025704421 [0,2,0,0,0,0|1,1,0]=4 10768 B16R1.1454 C=CCOC(=O)CSc1ccncc1CC 62a_100025704421_100000033060 [0,2,0,0,0,0|1,1,0]=4 10769 B16R1.1454 C=CCOC(=O)CSc1ccncc1CO 62a_100000033060_100000117392 [0,2,0,0,0,0|1,1,0]=4 10770 B16R1.1454 C=CCOC(=O)CSc1ccncc1CO 62a_100000117392_100000033060 [0,2,0,0,0,0|1,1,0]=4 10771 B16R1.1454 C=CCOC(=O)CSc1ccncc1OC 62a_100000033060_100016988167 [0,2,0,0,0,0|1,1,0]=4 10772 B16R1.1454 C=CCOC(=O)CSc1ccncc1OC 62a_100016988167_100000033060 [0,2,0,0,0,0|1,1,0]=4 10773 B16R1.1454 C=CCOC(=O)CSc1cnccc1C#N 62a_100000033060_100000684818 [0,2,0,0,0,0|1,1,0]=4 10774 B16R1.1454 C=CCOC(=O)CSc1cnccc1C=O 62a_100000033060_100011934409 [0,2,0,0,0,0|1,1,0]=4 10775 B16R1.1454 C=CCOC(=O)CSc1cnccc1C=O 62a_100011934409_100000033060 [0,2,0,0,0,0|1,1,0]=4 10776 B16R1.1454 C=CCOC(=O)CSc1cnccc1CC 62a_100000033060_100009819861 [0,2,0,0,0,0|1,1,0]=4 10777 B16R1.1454 C=CCOC(=O)CSc1cnccc1CC 62a_100009819861_100000033060 [0,2,0,0,0,0|1,1,0]=4 10778 B16R1.1454 C=CCOC(=O)CSc1cnccc1CN 62a_100000033060_100020640021 [0,2,0,0,0,0|1,1,0]=4 10779 B16R1.1454 C=CCOC(=O)CSc1cnccc1CN 62a_100020640021_100000033060 [0,2,0,0,0,0|1,1,0]=4 10780 B16R1.1454 C=CCOC(=O)CSc1cnccc1CO 62a_100000033060_100009873359 [0,2,0,0,0,0|1,1,0]=4 10781 B16R1.1454 C=CCOC(=O)CSc1cnccc1CO 62a_100009873359_100000033060 [0,2,0,0,0,0|1,1,0]=4 10782 B16R1.1454 C=CCOC(=O)CSc1cnccc1NC 62a_100000033060_100010069531 [0,2,0,0,0,0|1,1,0]=4 10783 B16R1.1454 C=CCOC(=O)CSc1cnccc1NC 62a_100010069531_100000033060 [0,2,0,0,0,0|1,1,0]=4 10784 B16R1.1454 C=CCOC(=O)CSc1cnccc1NN 62a_100000033060_100013404636 [0,2,0,0,0,0|1,1,0]=4 10785 B16R1.1454 C=CCOC(=O)CSc1cnccc1NN 62a_100013404636_100000033060 [0,2,0,0,0,0|1,1,0]=4 10786 B16R1.1454 C=CCOC(=O)CSc1cnccc1OC 62a_100000033060_100011997281 [0,2,0,0,0,0|1,1,0]=4 10787 B16R1.1454 C=CCOC(=O)CSc1cnccc1OC 62a_100011997281_100000033060 [0,2,0,0,0,0|1,1,0]=4 10788 B16R1.1454 C=CCOC(=O)CSc1ncccc1C#N 62a_100000033060_100000211984 [0,2,0,0,0,0|1,1,0]=4 10789 B16R1.1454 C=CCOC(=O)CSc1ncccc1C=O 62a_100000033060_100009816751 [0,2,0,0,0,0|1,1,0]=4 10790 B16R1.1454 C=CCOC(=O)CSc1ncccc1C=O 62a_100009816751_100000033060 [0,2,0,0,0,0|1,1,0]=4 10791 B16R1.1454 C=CCOC(=O)CSc1ncccc1CN 62a_100000033060_100015189234 [0,2,0,0,0,0|1,1,0]=4 10792 B16R1.1454 C=CCOC(=O)CSc1ncccc1CN 62a_100015189234_100000033060 [0,2,0,0,0,0|1,1,0]=4 10793 B16R1.1454 C=CCOC(=O)CSc1ncccc1CO 62a_100000033060_100000748726 [0,2,0,0,0,0|1,1,0]=4 10794 B16R1.1454 C=CCOC(=O)CSc1ncccc1CO 62a_100000748726_100000033060 [0,2,0,0,0,0|1,1,0]=4 10795 B16R1.1454 C=CCOC(=O)CSc1ncccc1NC 62a_100000033060_200011806188 [0,2,0,0,0,0|1,1,0]=4 10796 B16R1.1454 C=CCOC(=O)CSc1ncccc1OC 62a_100000033060_100000690851 [0,2,0,0,0,0|1,1,0]=4 10797 B16R1.1454 C=CCOC(=O)CSc1ncccc1OC 62a_100000767102_100000033060 [0,2,0,0,0,0|1,1,0]=4 10798 B16R1.1454 C=CCOC(C)COc1ccccc1OC 34a_100000242603_100015514636 [0,2,0,0,0,0|1,0,1]=4 10799 B16R1.1454 C=CCOC(C)COc1ccccc1OC 7a_100000242603_100015514636 [0,2,0,0,0,0|1,0,1]=4 10800 B16R1.1454 CCCOC(=O)COc1ccccc1C#N 34a_100000211048_200011215008 [0,2,0,0,0,0|0,0,2]=4 10801 B16R1.1454 CCCOC(=O)COc1ccccc1C#N 7a_100000211048_200011215008 [0,2,0,0,0,0|0,0,2]=4 10802 B16R1.1454 CCCOC(=O)COc1ccccc1CC 34a_100000210936_200011215008 [0,2,0,0,0,0|0,0,2]=4 10803 B16R1.1454 CCCOC(=O)COc1ccccc1CC 7a_100000210936_200011215008 [0,2,0,0,0,0|0,0,2]=4 10804 B16R1.1454 CCCOC(=O)COc1ccccc1CN 34a_100000185550_200011215008 [0,2,0,0,0,0|0,0,2]=4 10805 B16R1.1454 CCCOC(=O)COc1ccccc1CO 34a_100011216872_200011215008 [0,2,0,0,0,0|0,0,2]=4 10806 B16R1.1454 CCCOC(=O)COc1ccccc1NC 34a_100000033821_200011215008 [0,2,0,0,0,0|0,0,2]=4 10807 B16R1.1454 CCCOC(=O)COc1ccccc1OC 34a_100000210385_200011215008 [0,2,0,0,0,0|0,0,2]=4 10808 B16R1.1454 CCCOC(=O)COc1ccccc1SC 34a_100011216402_200011215008 [0,2,0,0,0,0|0,0,2]=4 10809 B16R1.90074 C=CCCC(=O)CCc1c(cccc1C)C 1458a_200011998103_100000754431 [0,2,0,0,0,0|2,0,0]=4 10810 B16R1.90074 C=CCCC(=O)CCc1c(cccc1Cl)Cl 1458a_100000749702_100012161200 [0,2,0,0,0,0|2,0,0]=4 10811 B16R1.90074 C=CCCC(=O)CCc1c(cccc1Cl)Cl 1458a_100011225048_100000754431 [0,2,0,0,0,0|2,0,0]=4 10812 B16R1.90074 C=CCCC(=O)CCc1c(cccc1Cl)F 1458a_100011225049_100000754431 [0,2,0,0,0,0|2,0,0]=4 10813 B16R1.90074 C=CCCC(=O)CCc1c(cccc1F)F 1458a_100000738981_100000754431 [0,2,0,0,0,0|2,0,0]=4 10814 B16R1.90074 C=CCCC(=O)COc1c(cccc1C)C 1458a_100000184085_100000754431 [0,2,0,0,0,0|1,0,0]=3 10815 B16R1.90074 C=CCCC(=O)COc1c(cccc1Cl)Cl 1458a_100000184137_100000754431 [0,2,0,0,0,0|1,0,0]=3 10816 B16R1.90074 C=CCCC(=O)CSc1c(cccc1Cl)Cl 1458a_100000184567_100000754431 [0,2,0,0,0,0|1,1,0]=4 10817 B16R1.90074 C=CCNC(=O)CCc1c(cccc1C)C 1626a_100020586998_200011998103 [0,2,0,0,0,0|2,0,0]=4 10818 B16R1.90074 C=CCNC(=O)CCc1c(cccc1C)C 240690a_100020586998_200011998103 [0,2,0,0,0,0|2,0,0]=4 10819 B16R1.90074 C=CCNC(=O)CCc1c(cccc1C)C 527a_100020586998_200011998103 [0,2,0,0,0,0|2,0,0]=4 10820 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)Cl 1626a_100020586998_100011225048 [0,2,0,0,0,0|2,0,0]=4 10821 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)Cl 240690a_100020586998_100011225048 [0,2,0,0,0,0|2,0,0]=4 10822 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)Cl 527a_100020586998_100011225048 [0,2,0,0,0,0|2,0,0]=4 10823 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)F 1626a_100020586998_100011225049 [0,2,0,0,0,0|2,0,0]=4 10824 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)F 240690a_100020586998_100011225049 [0,2,0,0,0,0|2,0,0]=4 10825 B16R1.90074 C=CCNC(=O)CCc1c(cccc1Cl)F 527a_100020586998_100011225049 [0,2,0,0,0,0|2,0,0]=4 10826 B16R1.90074 C=CCNC(=O)CCc1c(cccc1F)F 1626a_100020586998_100000738981 [0,2,0,0,0,0|2,0,0]=4 10827 B16R1.90074 C=CCNC(=O)CCc1c(cccc1F)F 240690a_100020586998_100000738981 [0,2,0,0,0,0|2,0,0]=4 10828 B16R1.90074 C=CCNC(=O)CCc1c(cccc1F)F 527a_100020586998_100000738981 [0,2,0,0,0,0|2,0,0]=4 10829 B16R1.90074 C=CCNC(=O)CNc1c(cccc1F)F 2230a_100000210704_100000183597 [0,2,0,0,0,0|2,0,0]=4 10830 B16R1.90074 C=CCNC(=O)COc1c(cccc1Br)Br 7a_100000736428_100000183597 [0,2,0,0,0,0|1,0,0]=3 10831 B16R1.90074 C=CCNC(=O)COc1c(cccc1Br)C 7a_100009817157_100000183597 [0,2,0,0,0,0|1,0,0]=3 10832 B16R1.90074 C=CCNC(=O)COc1c(cccc1Br)Cl 7a_100010214474_100000183597 [0,2,0,0,0,0|1,0,0]=3 10833 B16R1.90074 C=CCNC(=O)COc1c(cccc1Br)F 7a_100009813666_100000183597 [0,2,0,0,0,0|1,0,0]=3 10834 B16R1.90074 C=CCNC(=O)COc1c(cccc1C)C 1626a_100020586998_100000184085 [0,2,0,0,0,0|1,0,0]=3 10835 B16R1.90074 C=CCNC(=O)COc1c(cccc1C)C 240690a_100020586998_100000184085 [0,2,0,0,0,0|1,0,0]=3 10836 B16R1.90074 C=CCNC(=O)COc1c(cccc1C)C 527a_100020586998_100000184085 [0,2,0,0,0,0|1,0,0]=3 10837 B16R1.90074 C=CCNC(=O)COc1c(cccc1C)C 7a_100000210341_100000183597 [0,2,0,0,0,0|1,0,0]=3 10838 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)C 7a_100000033731_100000183597 [0,2,0,0,0,0|1,0,0]=3 10839 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)Cl 1626a_100020586998_100000184137 [0,2,0,0,0,0|1,0,0]=3 10840 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)Cl 240690a_100020586998_100000184137 [0,2,0,0,0,0|1,0,0]=3 10841 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)Cl 527a_100020586998_100000184137 [0,2,0,0,0,0|1,0,0]=3 10842 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)Cl 7a_100000211709_100000183597 [0,2,0,0,0,0|1,0,0]=3 10843 B16R1.90074 C=CCNC(=O)COc1c(cccc1Cl)F 7a_100000694953_100000183597 [0,2,0,0,0,0|1,0,0]=3 10844 B16R1.90074 C=CCNC(=O)COc1c(cccc1F)C 7a_100011659162_100000183597 [0,2,0,0,0,0|1,0,0]=3 10845 B16R1.90074 C=CCNC(=O)COc1c(cccc1F)F 7a_100000230165_100000183597 [0,2,0,0,0,0|1,0,0]=3 10846 B16R1.90074 C=CCNC(=O)COc1c(cccc1I)Br 7a_100010084509_100000183597 [0,2,0,0,0,0|1,0,0]=3 10847 B16R1.90074 C=CCNC(=O)COc1c(cccc1I)Cl 7a_100010202889_100000183597 [0,2,0,0,0,0|1,0,0]=3 10848 B16R1.90074 C=CCNC(=O)COc1c(cccc1I)F 7a_100010186298_100000183597 [0,2,0,0,0,0|1,0,0]=3 10849 B16R1.90074 C=CCNC(=O)COc1c(cccc1N)C 7a_100000756359_100000183597 [0,2,0,0,0,0|1,0,0]=3 10850 B16R1.90074 C=CCNC(=O)COc1c(ccnc1C)C 7a_100011934651_100000183597 [0,2,0,0,0,0|2,0,0]=4 10851 B16R1.90074 C=CCNC(=O)COc1c(ccnc1Cl)C 7a_100000696282_100000183597 [0,2,0,0,0,0|2,0,0]=4 10852 B16R1.90074 C=CCNC(=O)COc1c(ccnc1Cl)Cl 7a_100000118450_100000183597 [0,2,0,0,0,0|2,0,0]=4 10853 B16R1.90074 C=CCNC(=O)COc1c(ccnc1Cl)F 7a_100009867227_100000183597 [0,2,0,0,0,0|2,0,0]=4 10854 B16R1.90074 C=CCNC(=O)COc1c(ccnc1Cl)I 7a_100010067911_100000183597 [0,2,0,0,0,0|2,0,0]=4 10855 B16R1.90074 C=CCNC(=O)COc1c(ccnc1Cl)N 7a_100009844647_100000183597 [0,2,0,0,0,0|2,0,0]=4 10856 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)Br 62a_100000183597_100009994525 [0,2,0,0,0,0|1,1,0]=4 10857 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)Br 62a_100009994525_100000183597 [0,2,0,0,0,0|1,1,0]=4 10858 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)C 62a_100000183597_100010141302 [0,2,0,0,0,0|1,1,0]=4 10859 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)C 62a_100010141302_100000183597 [0,2,0,0,0,0|1,1,0]=4 10860 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)Cl 62a_100000183597_100010214488 [0,2,0,0,0,0|1,1,0]=4 10861 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)Cl 62a_100010214488_100000183597 [0,2,0,0,0,0|1,1,0]=4 10862 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)F 62a_100000183597_100011219512 [0,2,0,0,0,0|1,1,0]=4 10863 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)F 62a_100011219512_100000183597 [0,2,0,0,0,0|1,1,0]=4 10864 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)N 62a_100000183597_100020590159 [0,2,0,0,0,0|1,1,0]=4 10865 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)N 62a_100020590159_100000183597 [0,2,0,0,0,0|1,1,0]=4 10866 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)O 62a_100000183597_100010187912 [0,2,0,0,0,0|1,1,0]=4 10867 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Br)O 62a_100010187912_100000183597 [0,2,0,0,0,0|1,1,0]=4 10868 B16R1.90074 C=CCNC(=O)CSc1c(cccc1C)C 62a_100000033847_100000183597 [0,2,0,0,0,0|1,1,0]=4 10869 B16R1.90074 C=CCNC(=O)CSc1c(cccc1C)C 62a_100000183597_100000033847 [0,2,0,0,0,0|1,1,0]=4 10870 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)C 62a_100000043165_100000183597 [0,2,0,0,0,0|1,1,0]=4 10871 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)C 62a_100000183597_100000043165 [0,2,0,0,0,0|1,1,0]=4 10872 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)Cl 1626a_100020586998_100000184567 [0,2,0,0,0,0|1,1,0]=4 10873 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)Cl 240690a_100020586998_100000184567 [0,2,0,0,0,0|1,1,0]=4 10874 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)Cl 527a_100020586998_100000184567 [0,2,0,0,0,0|1,1,0]=4 10875 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)Cl 62a_100000034237_100000183597 [0,2,0,0,0,0|1,1,0]=4 10876 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)Cl 62a_100000183597_100000034237 [0,2,0,0,0,0|1,1,0]=4 10877 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)F 62a_100000050007_100000183597 [0,2,0,0,0,0|1,1,0]=4 10878 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)F 62a_100000183597_100000050007 [0,2,0,0,0,0|1,1,0]=4 10879 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)N 62a_100000049713_100000183597 [0,2,0,0,0,0|1,1,0]=4 10880 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)N 62a_100000183597_100000049713 [0,2,0,0,0,0|1,1,0]=4 10881 B16R1.90074 C=CCNC(=O)CSc1c(cccc1Cl)O 62a_100000183597_100000050174 [0,2,0,0,0,0|1,1,0]=4 10882 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)C 62a_100000183597_100011218421 [0,2,0,0,0,0|1,1,0]=4 10883 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)C 62a_100011218421_100000183597 [0,2,0,0,0,0|1,1,0]=4 10884 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)F 62a_100000183597_100000693133 [0,2,0,0,0,0|1,1,0]=4 10885 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)F 62a_100000693133_100000183597 [0,2,0,0,0,0|1,1,0]=4 10886 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)N 62a_100000183597_100000690935 [0,2,0,0,0,0|1,1,0]=4 10887 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)N 62a_100000690935_100000183597 [0,2,0,0,0,0|1,1,0]=4 10888 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)O 62a_100000183597_100009820682 [0,2,0,0,0,0|1,1,0]=4 10889 B16R1.90074 C=CCNC(=O)CSc1c(cccc1F)O 62a_100009820682_100000183597 [0,2,0,0,0,0|1,1,0]=4 10890 B16R1.90074 C=CCNC(=O)CSc1c(cccc1N)C 62a_100000183597_100000684715 [0,2,0,0,0,0|1,1,0]=4 10891 B16R1.90074 C=CCNC(=O)CSc1c(cccc1N)C 62a_100000684715_100000183597 [0,2,0,0,0,0|1,1,0]=4 10892 B16R1.90074 C=CCNC(=O)CSc1c(cccc1O)C 62a_100000183597_100000686692 [0,2,0,0,0,0|1,1,0]=4 10893 B16R1.90074 C=CCNC(=O)CSc1c(cccc1O)C 62a_100000686692_100000183597 [0,2,0,0,0,0|1,1,0]=4 10894 B16R1.90074 C=CCNC(=O)CSc1c(cccc1O)N 62a_100000183597_100012183704 [0,2,0,0,0,0|1,1,0]=4 10895 B16R1.90074 C=CCNC(=O)CSc1c(cccc1O)N 62a_100012183704_100000183597 [0,2,0,0,0,0|1,1,0]=4 10896 B16R1.90074 C=CCNC(=O)CSc1c(cccc1O)O 62a_100000183597_100010205330 [0,2,0,0,0,0|1,1,0]=4 10897 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Br)Br 34a_100000690995_100000033060 [0,2,0,0,0,0|1,0,0]=3 10898 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Br)C 34a_100011834072_100000033060 [0,2,0,0,0,0|1,0,0]=3 10899 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Br)Cl 34a_100102946385_100000033060 [0,2,0,0,0,0|1,0,0]=3 10900 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Br)F 34a_100000684712_100000033060 [0,2,0,0,0,0|1,0,0]=3 10901 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Br)O 34a_100011934926_100000033060 [0,2,0,0,0,0|1,0,0]=3 10902 B16R1.90074 C=CCOC(=O)CNc1c(cccc1C)C 34a_100000185769_100000033060 [0,2,0,0,0,0|1,0,0]=3 10903 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Cl)C 34a_100000756524_100000033060 [0,2,0,0,0,0|1,0,0]=3 10904 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Cl)Cl 34a_100000210028_100000033060 [0,2,0,0,0,0|1,0,0]=3 10905 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Cl)F 34a_100000760031_100000033060 [0,2,0,0,0,0|1,0,0]=3 10906 B16R1.90074 C=CCOC(=O)CNc1c(cccc1Cl)O 34a_100012022510_100000033060 [0,2,0,0,0,0|1,0,0]=3 10907 B16R1.90074 C=CCOC(=O)CNc1c(cccc1F)C 34a_100000766463_100000033060 [0,2,0,0,0,0|1,0,0]=3 10908 B16R1.90074 C=CCOC(=O)CNc1c(cccc1F)F 2230a_100000210704_100000033060 [0,2,0,0,0,0|1,0,0]=3 10909 B16R1.90074 C=CCOC(=O)CNc1c(cccc1F)F 34a_100000210704_100000033060 [0,2,0,0,0,0|1,0,0]=3 10910 B16R1.90074 C=CCOC(=O)CNc1c(cccc1F)O 34a_100020591140_100000033060 [0,2,0,0,0,0|1,0,0]=3 10911 B16R1.90074 C=CCOC(=O)CNc1c(cccc1I)F 34a_100000042321_100000033060 [0,2,0,0,0,0|1,0,0]=3 10912 B16R1.90074 C=CCOC(=O)CNc1c(cccc1O)C 34a_100000743429_100000033060 [0,2,0,0,0,0|1,0,0]=3 10913 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)Br 34a_100000736428_100000033060 [0,2,0,0,0,0|0,0,0]=2 10914 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)Br 7a_100000736428_100000033060 [0,2,0,0,0,0|0,0,0]=2 10915 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)C 34a_100009817157_100000033060 [0,2,0,0,0,0|0,0,0]=2 10916 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)C 7a_100009817157_100000033060 [0,2,0,0,0,0|0,0,0]=2 10917 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)Cl 34a_100010214474_100000033060 [0,2,0,0,0,0|0,0,0]=2 10918 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)Cl 7a_100010214474_100000033060 [0,2,0,0,0,0|0,0,0]=2 10919 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)F 34a_100009813666_100000033060 [0,2,0,0,0,0|0,0,0]=2 10920 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)F 7a_100009813666_100000033060 [0,2,0,0,0,0|0,0,0]=2 10921 B16R1.90074 C=CCOC(=O)COc1c(cccc1Br)N 34a_100011934915_100000033060 [0,2,0,0,0,0|0,0,0]=2 10922 B16R1.90074 C=CCOC(=O)COc1c(cccc1C)C 34a_100000210341_100000033060 [0,2,0,0,0,0|0,0,0]=2 10923 B16R1.90074 C=CCOC(=O)COc1c(cccc1C)C 7a_100000210341_100000033060 [0,2,0,0,0,0|0,0,0]=2 10924 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)C 34a_100000033731_100000033060 [0,2,0,0,0,0|0,0,0]=2 10925 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)C 7a_100000033731_100000033060 [0,2,0,0,0,0|0,0,0]=2 10926 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)Cl 34a_100000211709_100000033060 [0,2,0,0,0,0|0,0,0]=2 10927 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)Cl 7a_100000211709_100000033060 [0,2,0,0,0,0|0,0,0]=2 10928 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)F 34a_100000694953_100000033060 [0,2,0,0,0,0|0,0,0]=2 10929 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)F 7a_100000694953_100000033060 [0,2,0,0,0,0|0,0,0]=2 10930 B16R1.90074 C=CCOC(=O)COc1c(cccc1Cl)N 34a_100000754742_100000033060 [0,2,0,0,0,0|0,0,0]=2 10931 B16R1.90074 C=CCOC(=O)COc1c(cccc1F)C 34a_100011659162_100000033060 [0,2,0,0,0,0|0,0,0]=2 10932 B16R1.90074 C=CCOC(=O)COc1c(cccc1F)C 7a_100011659162_100000033060 [0,2,0,0,0,0|0,0,0]=2 10933 B16R1.90074 C=CCOC(=O)COc1c(cccc1F)F 34a_100000230165_100000033060 [0,2,0,0,0,0|0,0,0]=2 10934 B16R1.90074 C=CCOC(=O)COc1c(cccc1F)F 7a_100000230165_100000033060 [0,2,0,0,0,0|0,0,0]=2 10935 B16R1.90074 C=CCOC(=O)COc1c(cccc1F)N 34a_100011934987_100000033060 [0,2,0,0,0,0|0,0,0]=2 10936 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)Br 34a_100010084509_100000033060 [0,2,0,0,0,0|0,0,0]=2 10937 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)Br 7a_100010084509_100000033060 [0,2,0,0,0,0|0,0,0]=2 10938 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)Cl 34a_100010202889_100000033060 [0,2,0,0,0,0|0,0,0]=2 10939 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)Cl 7a_100010202889_100000033060 [0,2,0,0,0,0|0,0,0]=2 10940 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)F 34a_100010186298_100000033060 [0,2,0,0,0,0|0,0,0]=2 10941 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)F 7a_100010186298_100000033060 [0,2,0,0,0,0|0,0,0]=2 10942 B16R1.90074 C=CCOC(=O)COc1c(cccc1I)N 34a_100010084371_100000033060 [0,2,0,0,0,0|0,0,0]=2 10943 B16R1.90074 C=CCOC(=O)COc1c(cccc1N)C 34a_100000756359_100000033060 [0,2,0,0,0,0|0,0,0]=2 10944 B16R1.90074 C=CCOC(=O)COc1c(cccc1N)C 7a_100000756359_100000033060 [0,2,0,0,0,0|0,0,0]=2 10945 B16R1.90074 C=CCOC(=O)COc1c(cccc1N)N 34a_200016994477_100000033060 [0,2,0,0,0,0|0,0,0]=2 10946 B16R1.90074 C=CCOC(=O)COc1c(ccnc1C)C 34a_100011934651_100000033060 [0,2,0,0,0,0|1,0,0]=3 10947 B16R1.90074 C=CCOC(=O)COc1c(ccnc1C)C 7a_100011934651_100000033060 [0,2,0,0,0,0|1,0,0]=3 10948 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)C 34a_100000696282_100000033060 [0,2,0,0,0,0|1,0,0]=3 10949 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)C 7a_100000696282_100000033060 [0,2,0,0,0,0|1,0,0]=3 10950 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)Cl 34a_100000118450_100000033060 [0,2,0,0,0,0|1,0,0]=3 10951 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)Cl 7a_100000118450_100000033060 [0,2,0,0,0,0|1,0,0]=3 10952 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)F 34a_100009867227_100000033060 [0,2,0,0,0,0|1,0,0]=3 10953 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)F 7a_100009867227_100000033060 [0,2,0,0,0,0|1,0,0]=3 10954 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)I 34a_100010067911_100000033060 [0,2,0,0,0,0|1,0,0]=3 10955 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)I 7a_100010067911_100000033060 [0,2,0,0,0,0|1,0,0]=3 10956 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)N 34a_100009844647_100000033060 [0,2,0,0,0,0|1,0,0]=3 10957 B16R1.90074 C=CCOC(=O)COc1c(ccnc1Cl)N 7a_100009844647_100000033060 [0,2,0,0,0,0|1,0,0]=3 10958 B16R1.90074 C=CCOC(=O)COc1c(ncnc1C)C 34a_100009878406_100000033060 [0,2,0,0,0,0|2,0,0]=4 10959 B16R1.90074 C=CCOC(=O)COc1c(ncnc1C)C 7a_100009878406_100000033060 [0,2,0,0,0,0|2,0,0]=4 10960 B16R1.90074 C=CCOC(=O)COc1c(ncnc1Cl)Cl 34a_100009876168_100000033060 [0,2,0,0,0,0|2,0,0]=4 10961 B16R1.90074 C=CCOC(=O)COc1c(ncnc1Cl)Cl 7a_100009876168_100000033060 [0,2,0,0,0,0|2,0,0]=4 10962 B16R1.90074 C=CCOC(=O)COc1c(ncnc1Cl)N 34a_100000124137_100000033060 [0,2,0,0,0,0|2,0,0]=4 10963 B16R1.90074 C=CCOC(=O)COc1c(ncnc1Cl)N 7a_100000124137_100000033060 [0,2,0,0,0,0|2,0,0]=4 10964 B16R1.90074 C=CCOC(=O)COc1c(occc1=O)C 34a_100000031901_100000033060 [0,2,0,0,0,0|1,0,0]=3 10965 B16R1.90074 C=CCOC(=O)CSc1c(ccc[n+]1[O-])C 62a_100000033060_100116209805 [0,2,0,0,0,0|1,1,0]=4 10966 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)Br 62a_100000033060_100009994525 [0,2,0,0,0,0|0,1,0]=3 10967 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)Br 62a_100009994525_100000033060 [0,2,0,0,0,0|0,1,0]=3 10968 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)C 62a_100000033060_100010141302 [0,2,0,0,0,0|0,1,0]=3 10969 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)C 62a_100010141302_100000033060 [0,2,0,0,0,0|0,1,0]=3 10970 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)Cl 62a_100000033060_100010214488 [0,2,0,0,0,0|0,1,0]=3 10971 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)Cl 62a_100010214488_100000033060 [0,2,0,0,0,0|0,1,0]=3 10972 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)F 62a_100000033060_100011219512 [0,2,0,0,0,0|0,1,0]=3 10973 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)F 62a_100011219512_100000033060 [0,2,0,0,0,0|0,1,0]=3 10974 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)N 62a_100000033060_100020590159 [0,2,0,0,0,0|0,1,0]=3 10975 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)N 62a_100020590159_100000033060 [0,2,0,0,0,0|0,1,0]=3 10976 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)O 62a_100000033060_100010187912 [0,2,0,0,0,0|0,1,0]=3 10977 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Br)O 62a_100010187912_100000033060 [0,2,0,0,0,0|0,1,0]=3 10978 B16R1.90074 C=CCOC(=O)CSc1c(cccc1C)C 62a_100000033060_100000033847 [0,2,0,0,0,0|0,1,0]=3 10979 B16R1.90074 C=CCOC(=O)CSc1c(cccc1C)C 62a_100000033847_100000033060 [0,2,0,0,0,0|0,1,0]=3 10980 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)C 62a_100000033060_100000043165 [0,2,0,0,0,0|0,1,0]=3 10981 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)C 62a_100000043165_100000033060 [0,2,0,0,0,0|0,1,0]=3 10982 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)Cl 62a_100000033060_100000034237 [0,2,0,0,0,0|0,1,0]=3 10983 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)Cl 62a_100000034237_100000033060 [0,2,0,0,0,0|0,1,0]=3 10984 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)F 62a_100000033060_100000050007 [0,2,0,0,0,0|0,1,0]=3 10985 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)F 62a_100000050007_100000033060 [0,2,0,0,0,0|0,1,0]=3 10986 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)N 62a_100000033060_100000049713 [0,2,0,0,0,0|0,1,0]=3 10987 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)N 62a_100000049713_100000033060 [0,2,0,0,0,0|0,1,0]=3 10988 B16R1.90074 C=CCOC(=O)CSc1c(cccc1Cl)O 62a_100000033060_100000050174 [0,2,0,0,0,0|0,1,0]=3 10989 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)C 62a_100000033060_100011218421 [0,2,0,0,0,0|0,1,0]=3 10990 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)C 62a_100011218421_100000033060 [0,2,0,0,0,0|0,1,0]=3 10991 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)F 62a_100000033060_100000693133 [0,2,0,0,0,0|0,1,0]=3 10992 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)F 62a_100000693133_100000033060 [0,2,0,0,0,0|0,1,0]=3 10993 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)N 62a_100000033060_100000690935 [0,2,0,0,0,0|0,1,0]=3 10994 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)N 62a_100000690935_100000033060 [0,2,0,0,0,0|0,1,0]=3 10995 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)O 62a_100000033060_100009820682 [0,2,0,0,0,0|0,1,0]=3 10996 B16R1.90074 C=CCOC(=O)CSc1c(cccc1F)O 62a_100009820682_100000033060 [0,2,0,0,0,0|0,1,0]=3 10997 B16R1.90074 C=CCOC(=O)CSc1c(cccc1N)C 62a_100000033060_100000684715 [0,2,0,0,0,0|0,1,0]=3 10998 B16R1.90074 C=CCOC(=O)CSc1c(cccc1N)C 62a_100000684715_100000033060 [0,2,0,0,0,0|0,1,0]=3 10999 B16R1.90074 C=CCOC(=O)CSc1c(cccc1O)C 62a_100000033060_100000686692 [0,2,0,0,0,0|0,1,0]=3 11000 B16R1.90074 C=CCOC(=O)CSc1c(cccc1O)C 62a_100000686692_100000033060 [0,2,0,0,0,0|0,1,0]=3 11001 B16R1.90074 C=CCOC(=O)CSc1c(cccc1O)N 62a_100000033060_100012183704 [0,2,0,0,0,0|0,1,0]=3 11002 B16R1.90074 C=CCOC(=O)CSc1c(cccc1O)N 62a_100012183704_100000033060 [0,2,0,0,0,0|0,1,0]=3 11003 B16R1.90074 C=CCOC(=O)CSc1c(cccc1O)O 62a_100000033060_100010205330 [0,2,0,0,0,0|0,1,0]=3 11004 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1C)C 62a_100000033060_100012000501 [0,2,0,0,0,0|1,1,0]=4 11005 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1C)C 62a_100012000501_100000033060 [0,2,0,0,0,0|1,1,0]=4 11006 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1C)N 62a_100000033060_100010243816 [0,2,0,0,0,0|1,1,0]=4 11007 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1C)N 62a_100010243816_100000033060 [0,2,0,0,0,0|1,1,0]=4 11008 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)Br 62a_100000033060_100009814607 [0,2,0,0,0,0|1,1,0]=4 11009 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)Br 62a_100009814607_100000033060 [0,2,0,0,0,0|1,1,0]=4 11010 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)C 62a_100000033060_100010248874 [0,2,0,0,0,0|1,1,0]=4 11011 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)C 62a_100010248874_100000033060 [0,2,0,0,0,0|1,1,0]=4 11012 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)Cl 62a_100000033060_100000050019 [0,2,0,0,0,0|1,1,0]=4 11013 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)Cl 62a_100000050019_100000033060 [0,2,0,0,0,0|1,1,0]=4 11014 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)F 62a_100000033060_100000716511 [0,2,0,0,0,0|1,1,0]=4 11015 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)F 62a_100000716511_100000033060 [0,2,0,0,0,0|1,1,0]=4 11016 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)N 62a_100000033060_100010208016 [0,2,0,0,0,0|1,1,0]=4 11017 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1Cl)N 62a_100010208016_100000033060 [0,2,0,0,0,0|1,1,0]=4 11018 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)C 62a_100000033060_100009818256 [0,2,0,0,0,0|1,1,0]=4 11019 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)C 62a_100009818256_100000033060 [0,2,0,0,0,0|1,1,0]=4 11020 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)F 62a_100000033060_100009874084 [0,2,0,0,0,0|1,1,0]=4 11021 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)F 62a_100009874084_100000033060 [0,2,0,0,0,0|1,1,0]=4 11022 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)N 62a_100000033060_100010381272 [0,2,0,0,0,0|1,1,0]=4 11023 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1F)N 62a_100010381272_100000033060 [0,2,0,0,0,0|1,1,0]=4 11024 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1N)C 62a_100000033060_100011998619 [0,2,0,0,0,0|1,1,0]=4 11025 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1N)C 62a_100011998619_100000033060 [0,2,0,0,0,0|1,1,0]=4 11026 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1N)Cl 62a_100000033060_100010199028 [0,2,0,0,0,0|1,1,0]=4 11027 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1N)Cl 62a_100010199028_100000033060 [0,2,0,0,0,0|1,1,0]=4 11028 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1O)C 62a_100000033060_100012000493 [0,2,0,0,0,0|1,1,0]=4 11029 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1O)C 62a_100012000493_100000033060 [0,2,0,0,0,0|1,1,0]=4 11030 B16R1.90074 C=CCOC(=O)CSc1c(ccnc1O)O 62a_100000033060_200009817435 [0,2,0,0,0,0|1,1,0]=4 11031 B16R1.90074 C=CCOC(=O)CSc1c(cncc1Br)Br 62a_100000033060_100010172828 [0,2,0,0,0,0|1,1,0]=4 11032 B16R1.90074 C=CCOC(=O)CSc1c(cncc1Br)Br 62a_100010172828_100000033060 [0,2,0,0,0,0|1,1,0]=4 11033 B16R1.90074 C=CCOC(=O)CSc1c(cncc1C)C 62a_100000033060_100009817138 [0,2,0,0,0,0|1,1,0]=4 11034 B16R1.90074 C=CCOC(=O)CSc1c(cncc1C)C 62a_100009817138_100000033060 [0,2,0,0,0,0|1,1,0]=4 11035 B16R1.90074 C=CCOC(=O)CSc1c(cncc1Cl)Cl 62a_100000033060_100000036193 [0,2,0,0,0,0|1,1,0]=4 11036 B16R1.90074 C=CCOC(=O)CSc1c(cncc1Cl)Cl 62a_100000036193_100000033060 [0,2,0,0,0,0|1,1,0]=4 11037 B16R1.90074 C=CCOC(=O)CSc1c(cncc1F)F 62a_100000033060_100000760538 [0,2,0,0,0,0|1,1,0]=4 11038 B16R1.90074 C=CCOC(=O)CSc1c(cncc1F)F 62a_100000760538_100000033060 [0,2,0,0,0,0|1,1,0]=4 11039 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)Br 34a_100000736428_200011215008 [0,2,0,0,0,0|0,0,2]=4 11040 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)Br 7a_100000736428_200011215008 [0,2,0,0,0,0|0,0,2]=4 11041 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)C 34a_100009817157_200011215008 [0,2,0,0,0,0|0,0,2]=4 11042 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)C 7a_100009817157_200011215008 [0,2,0,0,0,0|0,0,2]=4 11043 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)Cl 34a_100010214474_200011215008 [0,2,0,0,0,0|0,0,2]=4 11044 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)Cl 7a_100010214474_200011215008 [0,2,0,0,0,0|0,0,2]=4 11045 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)F 34a_100009813666_200011215008 [0,2,0,0,0,0|0,0,2]=4 11046 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)F 7a_100009813666_200011215008 [0,2,0,0,0,0|0,0,2]=4 11047 B16R1.90074 CCCOC(=O)COc1c(cccc1Br)N 34a_100011934915_200011215008 [0,2,0,0,0,0|0,0,2]=4 11048 B16R1.90074 CCCOC(=O)COc1c(cccc1C)C 34a_100000210341_200011215008 [0,2,0,0,0,0|0,0,2]=4 11049 B16R1.90074 CCCOC(=O)COc1c(cccc1C)C 7a_100000210341_200011215008 [0,2,0,0,0,0|0,0,2]=4 11050 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)C 34a_100000033731_200011215008 [0,2,0,0,0,0|0,0,2]=4 11051 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)C 7a_100000033731_200011215008 [0,2,0,0,0,0|0,0,2]=4 11052 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)Cl 34a_100000211709_200011215008 [0,2,0,0,0,0|0,0,2]=4 11053 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)Cl 7a_100000211709_200011215008 [0,2,0,0,0,0|0,0,2]=4 11054 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)F 34a_100000694953_200011215008 [0,2,0,0,0,0|0,0,2]=4 11055 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)F 7a_100000694953_200011215008 [0,2,0,0,0,0|0,0,2]=4 11056 B16R1.90074 CCCOC(=O)COc1c(cccc1Cl)N 34a_100000754742_200011215008 [0,2,0,0,0,0|0,0,2]=4 11057 B16R1.90074 CCCOC(=O)COc1c(cccc1F)C 34a_100011659162_200011215008 [0,2,0,0,0,0|0,0,2]=4 11058 B16R1.90074 CCCOC(=O)COc1c(cccc1F)C 7a_100011659162_200011215008 [0,2,0,0,0,0|0,0,2]=4 11059 B16R1.90074 CCCOC(=O)COc1c(cccc1F)F 34a_100000230165_200011215008 [0,2,0,0,0,0|0,0,2]=4 11060 B16R1.90074 CCCOC(=O)COc1c(cccc1F)F 7a_100000230165_200011215008 [0,2,0,0,0,0|0,0,2]=4 11061 B16R1.90074 CCCOC(=O)COc1c(cccc1F)N 34a_100011934987_200011215008 [0,2,0,0,0,0|0,0,2]=4 11062 B16R1.90074 CCCOC(=O)COc1c(cccc1I)Br 34a_100010084509_200011215008 [0,2,0,0,0,0|0,0,2]=4 11063 B16R1.90074 CCCOC(=O)COc1c(cccc1I)Br 7a_100010084509_200011215008 [0,2,0,0,0,0|0,0,2]=4 11064 B16R1.90074 CCCOC(=O)COc1c(cccc1I)Cl 34a_100010202889_200011215008 [0,2,0,0,0,0|0,0,2]=4 11065 B16R1.90074 CCCOC(=O)COc1c(cccc1I)Cl 7a_100010202889_200011215008 [0,2,0,0,0,0|0,0,2]=4 11066 B16R1.90074 CCCOC(=O)COc1c(cccc1I)F 34a_100010186298_200011215008 [0,2,0,0,0,0|0,0,2]=4 11067 B16R1.90074 CCCOC(=O)COc1c(cccc1I)F 7a_100010186298_200011215008 [0,2,0,0,0,0|0,0,2]=4 11068 B16R1.90074 CCCOC(=O)COc1c(cccc1I)N 34a_100010084371_200011215008 [0,2,0,0,0,0|0,0,2]=4 11069 B16R1.90074 CCCOC(=O)COc1c(cccc1N)C 34a_100000756359_200011215008 [0,2,0,0,0,0|0,0,2]=4 11070 B16R1.90074 CCCOC(=O)COc1c(cccc1N)C 7a_100000756359_200011215008 [0,2,0,0,0,0|0,0,2]=4 11071 B16R1.90074 CCCOC(=O)COc1c(cccc1N)N 34a_200016994477_200011215008 [0,2,0,0,0,0|0,0,2]=4 11072 B16R1.6627 C=C(C)COC(CN)COc1ccccc1 34a_100000738913_100000748629 [0,2,0,0,0,0|1,0,1]=4 11073 B16R1.6627 C=C(F)COC(CN)COc1ccccc1 34a_100000738913_100009893438 [0,2,0,0,0,0|1,0,1]=4 11074 B16R1.22556 CC(C)(C)COC(=O)COc1ccccc1 34a_100000210340_200010402935 [0,2,0,0,0,0|0,0,2]=4 11075 B16R1.22556 CC(C)(C)COC(=O)COc1ccccc1 7a_100000210340_200010402935 [0,2,0,0,0,0|0,0,2]=4 11076 B14R1.177 C=CCOC(=O)COCc1ccco1 34a_100000210059_100000033060 [0,0,1,1,0,0|1,0,1]=4 11077 B14R1.177 C=CCOC(=O)COCc1cccs1 34a_100000211240_100000033060 [0,0,1,1,0,0|1,0,1]=4 11078 B14R1.177 C=CCOC(=O)COCc1ccoc1 34a_100011215357_100000033060 [0,0,1,1,0,0|1,0,1]=4 11079 B14R1.177 C=CCOC(=O)COCc1ccsc1 34a_100011215551_100000033060 [0,0,1,1,0,0|1,0,1]=4 11080 B14R2.3 C=CCNC1COc2c1cccc2 2230a_100000747519_100000210623 [1,0,0,1,0,0|1,0,1]=4 11081 B14R2.3 C=CCOC1CCc2c1cccc2 34a_100000212247_100015514636 [1,0,0,1,0,0|1,0,1]=4 11082 B14R2.3 C=CCOC1CCc2c1cccc2 7a_100000212247_100015514636 [1,0,0,1,0,0|1,0,1]=4 11083 B14R2.3 C=CCOc1csc2c1cccc2 34a_100000077758_100015514636 [1,0,0,1,0,0|0,1,1]=4 11084 B14R2.3 C=CCOc1csc2c1cccc2 7a_100000077758_100015514636 [1,0,0,1,0,0|0,1,1]=4 11085 B14R2.3 C=CCSc1coc2c1cccc2 62a_100000210623_100009812202 [1,0,0,1,0,0|0,1,1]=4 11086 B14R2.3 C=CCSc1noc2c1cccc2 62a_100000210623_200000703156 [1,0,0,1,0,0|1,1,0]=4 11087 B14R2.3 C=CCSc1noc2c1cccc2 62a_200000703156_100000210623 [1,0,0,1,0,0|1,1,0]=4 11088 B14R2.6 C1=CC(CCC1)Oc2ccccc2 7a_100000210340_100000751183 [1,0,0,1,0,0|1,0,1]=4 11089 B14R2.101 c1ccc(cc1)NCc2ccco2 207a_100000106764_100000186105 [1,0,0,1,0,0|1,0,1]=4 11090 B14R2.101 c1ccc(cc1)NCc2ccco2 270302a_100000106764_100000186105 [1,0,0,1,0,0|1,0,1]=4 11091 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 34a_100000210340_100000728653 [1,0,0,1,0,0|2,0,0]=4 11092 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 7a_100000210340_100000728653 [1,0,0,1,0,0|2,0,0]=4 11093 B14R2.101 c1ccc(cc1)OCc2ccon2 34a_100000210340_100000234950 [1,0,0,1,0,0|2,0,0]=4 11094 B14R2.101 c1ccc(cc1)OCc2ccon2 7a_100000210340_100000234950 [1,0,0,1,0,0|2,0,0]=4 11095 B14R2.101 c1ccc(cc1)OCc2ccsc2 34a_100000210340_100011261437 [1,0,0,1,0,0|2,0,0]=4 11096 B14R2.101 c1ccc(cc1)OCc2ccsc2 7a_100000210340_100011261437 [1,0,0,1,0,0|2,0,0]=4 11097 B14R2.101 c1ccc(cc1)OCc2ncco2 34a_100000210340_103436540062 [1,0,0,1,0,0|1,0,1]=4 11098 B14R2.101 c1ccc(cc1)OCc2ncco2 7a_100000210340_103436540062 [1,0,0,1,0,0|1,0,1]=4 11099 B14R2.16538 C=CCOCC1Cc2c1cccc2 34a_100012476685_100015514636 [1,0,0,1,0,0|1,0,1]=4 11100 B14R2.16538 C=CCOCC1Cc2c1cccc2 7a_100012476685_100015514636 [1,0,0,1,0,0|1,0,1]=4 11101 B14R2.2899 O=C(COc1ccccc1)C2CC2 34a_100000210340_100000746382 [1,0,0,1,0,0|0,0,2]=4 11102 B14R2.2899 O=C(COc1ccccc1)C2CC2 7a_100000210340_100000746382 [1,0,0,1,0,0|0,0,2]=4 11103 B14R2.33858 C=CCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210623 [1,0,0,1,0,0|1,0,0]=3 11104 B14R2.67 C=CCOC1Cc2ccccc2C1 34a_100011215286_100015514636 [0,0,0,1,1,0|1,0,1]=4 11105 B14R2.67 C=CCOC1Cc2ccccc2C1 34a_200000210373_100000753484 [0,0,0,1,1,0|1,0,1]=4 11106 B14R2.67 C=CCSc1cc2ccccc2o1 62a_100000210623_100010159458 [0,0,0,1,1,0|1,1,0]=4 11107 B14R2.4572 O=C1COC(=O)C1Oc2ccsc2 34a_100000106738_100000032967 [0,0,0,1,1,0|2,0,0]=4 11108 B16R2.37 C=CCCC(=O)C1C=Cc2c1cccc2 1458a_200009832160_100000754431 [0,0,0,1,0,1|2,0,0]=4 11109 B16R2.37 C=CCCC(=O)C1CCc2c1cccc2 1458a_100000750891_100000754431 [0,0,0,1,0,1|2,0,0]=4 11110 B16R2.37 C=CCNC(=O)C1C=Cc2c1cccc2 1626a_100020586998_200009832160 [0,0,0,1,0,1|2,0,0]=4 11111 B16R2.37 C=CCNC(=O)C1C=Cc2c1cccc2 240690a_100020586998_200009832160 [0,0,0,1,0,1|2,0,0]=4 11112 B16R2.37 C=CCNC(=O)C1C=Cc2c1cccc2 527a_100020586998_200009832160 [0,0,0,1,0,1|2,0,0]=4 11113 B16R2.37 C=CCNC(=O)C1CCc2c1cccc2 1626a_100020586998_100000750891 [0,0,0,1,0,1|2,0,0]=4 11114 B16R2.37 C=CCNC(=O)C1CCc2c1cccc2 240690a_100020586998_100000750891 [0,0,0,1,0,1|2,0,0]=4 11115 B16R2.37 C=CCNC(=O)C1CCc2c1cccc2 527a_100020586998_100000750891 [0,0,0,1,0,1|2,0,0]=4 11116 B16R2.71 O=c1occcc1OCc2ccccc2 34a_100000077404_100015291786 [0,0,0,1,0,1|0,0,2]=4 11117 B16R2.71 O=c1occcc1OCc2ccccc2 7a_100000077404_100000211182 [0,0,0,1,0,1|0,0,2]=4 11118 B16R2.2114 C=CCCC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_100000754431 [0,0,0,1,0,1|2,0,0]=4 11119 B16R2.2114 C=CCNC(=O)[C@@H]1C[C@H]1c2ccccc2 240690a_100020586998_100009815801 [0,0,0,1,0,1|2,0,0]=4 11120 B16R2.2114 C=CCNC(=O)[C@@H]1C[C@H]1c2ccccc2 527a_100020586998_100009815801 [0,0,0,1,0,1|2,0,0]=4 11121 B16R2.2948 O=C1CCC(=O)C1OCc2ccccc2 7a_100000210790_100009820769 [0,0,0,1,0,1|2,0,0]=4 11122 B16R2.2948 O=C1COC(=O)C1NCc2ccccc2 34a_100015324214_100000032967 [0,0,0,1,0,1|2,0,0]=4 11123 B16R2.2948 O=C1COC(=O)C1OCc2ccccc2 34a_100000210790_100000032967 [0,0,0,1,0,1|1,0,0]=3 11124 B16R2.2948 O=C1COC(=O)C1SCc2ccccc2 62a_100000211182_100000032967 [0,0,0,1,0,1|1,1,0]=4 11125 B16R2.296 O=C1CCC1C(=O)COc2ccccc2 1458a_100000186222_100009892977 [0,1,0,1,0,0|1,0,1]=4 11126 B16R2.2238 O=C(CCc1ccccc1)C2CC=CC2 1458a_100000759439_100000765856 [0,1,0,1,0,0|2,0,0]=4 11127 B16R2.2238 O=C(CCc1ccccc1)N2CC=CC2 1626a_100015195280_100000185753 [0,1,0,1,0,0|2,0,0]=4 11128 B16R2.2238 O=C(CCc1ccccc1)N2CC=CC2 240690a_100015195280_100000185753 [0,1,0,1,0,0|2,0,0]=4 11129 B16R2.2238 O=C(COc1ccccc1)N2CC=CC2 1626a_100015195280_100000186222 [0,1,0,1,0,0|1,0,0]=3 11130 B16R2.2238 O=C(COc1ccccc1)N2CC=CC2 240690a_100015195280_100000186222 [0,1,0,1,0,0|1,0,0]=3 11131 B16R2.2238 O=C(COc1ccccc1)c2ccc[nH]2 7a_100000210340_200011262396 [0,1,0,1,0,0|1,0,1]=4 11132 B16R2.2238 O=C(COc1ccccc1)c2ccco2 7a_100000210340_100000211439 [0,1,0,1,0,0|0,0,1]=3 11133 B16R2.2238 O=C(COc1ccccc1)c2cccs2 7a_100000210340_100000211436 [0,1,0,1,0,0|0,1,1]=4 11134 B16R2.2238 O=C(COc1ccccc1)c2ccsc2 34a_100000210340_100011219462 [0,1,0,1,0,0|1,0,1]=4 11135 B16R2.2238 O=C(COc1ccccc1)c2ccsc2 7a_100000210340_100011219462 [0,1,0,1,0,0|1,0,1]=4 11136 B16R2.2238 O=C(COc1ccccc1)c2nccs2 7a_100000210340_100000718653 [0,1,0,1,0,0|2,0,0]=4 11137 B16R2.2238 O=C(COc1ccccc1)n2cccn2 7a_100000210340_100000077511 [0,1,0,1,0,0|1,0,1]=4 11138 B16R2.2238 O=C(COc1ccccn1)N2CC=CC2 1626a_100015195280_100102699861 [0,1,0,1,0,0|2,0,0]=4 11139 B16R2.2238 O=C(COc1ccccn1)N2CC=CC2 240690a_100015195280_100102699861 [0,1,0,1,0,0|2,0,0]=4 11140 B16R2.2238 O=C(COc1cccnc1)N2CC=CC2 1626a_100015195280_100015207166 [0,1,0,1,0,0|2,0,0]=4 11141 B16R2.2238 O=C(COc1cccnc1)N2CC=CC2 240690a_100015195280_100015207166 [0,1,0,1,0,0|2,0,0]=4 11142 B16R2.2238 O=C(COc1cccnc1)c2ccco2 7a_100000210849_100000211439 [0,1,0,1,0,0|1,0,1]=4 11143 B16R2.2238 O=C(CSc1ccccc1)N2CC=CC2 1626a_100015195280_100000211596 [0,1,0,1,0,0|1,1,0]=4 11144 B16R2.2238 O=C(CSc1ccccc1)N2CC=CC2 240690a_100015195280_100000211596 [0,1,0,1,0,0|1,1,0]=4 11145 B16R2.2238 O=C(CSc1ccccc1)c2ccco2 62a_100000211439_100000041952 [0,1,0,1,0,0|0,1,1]=4 11146 B16R2.2238 O=C(CSc1ccccc1)c2ccco2 62a_100000719477_100000211439 [0,1,0,1,0,0|0,1,1]=4 11147 B16R2.2441 C=CCNCC1=Cc2ccccc2OC1 270004a_100020586998_100000013085 [0,1,0,1,0,0|2,0,0]=4 11148 B16R2.2441 C=CCOCC1COc2ccccc2C1 34a_100011273996_100015514636 [0,1,0,1,0,0|1,0,1]=4 11149 B16R2.2441 C=CCOCC1COc2ccccc2O1 34a_100000184353_100015514636 [0,1,0,1,0,0|0,0,2]=4 11150 B16R2.2441 C=CCOCC1COc2ccccc2O1 34a_200000210373_100011215957 [0,1,0,1,0,0|0,0,2]=4 11151 B16R2.3259 O=C1CCCC(=O)C1Oc2ccccc2 7a_100000210340_100009814513 [0,1,0,1,0,0|1,0,1]=4 11152 B16R2.43746 C=CCCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000757094 [0,1,0,1,0,0|2,0,0]=4 11153 B16R2.43746 C=CCCNC(=O)C1Cc2c1cccc2 11a_100015191253_200000238571 [0,1,0,1,0,0|2,0,0]=4 11154 B16R2.43746 C=CCCNC(=O)C1Cc2c1cccc2 1626a_100015191253_200000238571 [0,1,0,1,0,0|2,0,0]=4 11155 B16R2.43746 C=CCCNC(=O)C1Cc2c1cccc2 240690a_100015191253_200000238571 [0,1,0,1,0,0|2,0,0]=4 11156 B16R2.43746 C=CCCNC(=O)C1Cc2c1cccc2 527a_100015191253_200000238571 [0,1,0,1,0,0|2,0,0]=4 11157 B16R2.43746 C=CCNNC(=O)C1Cc2c1cccc2 22a_100020588587_200000238571 [0,1,0,1,0,0|2,0,0]=4 11158 B16R2.43746 C=COCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000039644 [0,1,0,1,0,0|2,0,0]=4 11159 B16R2.5948 CN(c1ccccc1)C2C(=O)COC2=O 269982a_100000210012_100000032967 [0,1,0,1,0,0|2,0,0]=4 11160 B16R2.5948 CN(c1ccccc1)C2C(=O)COC2=O 34a_100000210012_100000032967 [0,1,0,1,0,0|2,0,0]=4 11161 B16R2.11911 Cc1cc(ccn1)OC2C(=O)COC2=O 34a_100000688365_100000032967 [0,1,0,1,0,0|2,0,0]=4 11162 B16R2.11911 Cc1cccc(c1)NC2C(=O)COC2=O 34a_100000188690_100000032967 [0,1,0,1,0,0|2,0,0]=4 11163 B16R2.11911 Cc1cccc(c1)OC2C(=O)CCC2=O 7a_100000210337_100009820769 [0,1,0,1,0,0|2,0,0]=4 11164 B16R2.11911 Cc1cccc(c1)OC2C(=O)COC2=O 34a_100000210337_100000032967 [0,1,0,1,0,0|1,0,0]=3 11165 B16R2.11911 Cc1cccc(c1)SC2C(=O)COC2=O 62a_100011215228_100000032967 [0,1,0,1,0,0|1,1,0]=4 11166 B16R2.11911 Cc1cncc(c1)OC2C(=O)COC2=O 34a_100011830280_100000032967 [0,1,0,1,0,0|2,0,0]=4 11167 B16R2.11911 Nc1cc(ccn1)OC2C(=O)COC2=O 34a_100011834064_100000032967 [0,1,0,1,0,0|2,0,0]=4 11168 B16R2.11911 Nc1cccc(c1)OC2C(=O)COC2=O 34a_100000210217_100000032967 [0,1,0,1,0,0|1,0,0]=3 11169 B16R2.11911 Nc1cccc(c1)SC2C(=O)COC2=O 62a_100000210019_100000032967 [0,1,0,1,0,0|1,1,0]=4 11170 B16R2.11911 Nc1cncc(c1)OC2C(=O)COC2=O 34a_100011997051_100000032967 [0,1,0,1,0,0|2,0,0]=4 11171 B16R2.11911 O=C1CCC(=O)C1Oc2cccc(c2)Br 7a_100000210342_100009820769 [0,1,0,1,0,0|2,0,0]=4 11172 B16R2.11911 O=C1CCC(=O)C1Oc2cccc(c2)Cl 7a_100000210295_100009820769 [0,1,0,1,0,0|2,0,0]=4 11173 B16R2.11911 O=C1CCC(=O)C1Oc2cccc(c2)F 7a_100000210426_100009820769 [0,1,0,1,0,0|2,0,0]=4 11174 B16R2.11911 O=C1CCC(=O)C1Oc2cccc(c2)I 7a_100000211634_100009820769 [0,1,0,1,0,0|2,0,0]=4 11175 B16R2.11911 O=C1COC(=O)C1Nc2cccc(c2)Br 34a_100000210019_100000032967 [0,1,0,1,0,0|2,0,0]=4 11176 B16R2.11911 O=C1COC(=O)C1Nc2cccc(c2)Cl 34a_100000185859_100000032967 [0,1,0,1,0,0|2,0,0]=4 11177 B16R2.11911 O=C1COC(=O)C1Nc2cccc(c2)F 34a_100000210047_100000032967 [0,1,0,1,0,0|2,0,0]=4 11178 B16R2.11911 O=C1COC(=O)C1Nc2cccc(c2)I 34a_100000211102_100000032967 [0,1,0,1,0,0|2,0,0]=4 11179 B16R2.11911 O=C1COC(=O)C1Nc2cccc(c2)O 34a_100000210217_100000032967 [0,1,0,1,0,0|2,0,0]=4 11180 B16R2.11911 O=C1COC(=O)C1Oc2cc[nH]c(=O)c2 34a_100000032262_100000032967 [0,1,0,1,0,0|2,0,0]=4 11181 B16R2.11911 O=C1COC(=O)C1Oc2ccc[n+](c2)[O-] 34a_100000039713_100000032967 [0,1,0,1,0,0|2,0,0]=4 11182 B16R2.11911 O=C1COC(=O)C1Oc2cccc(=O)[nH]2 34a_100000033347_100000032967 [0,1,0,1,0,0|2,0,0]=4 11183 B16R2.11911 O=C1COC(=O)C1Oc2cccc(c2)Br 34a_100000210342_100000032967 [0,1,0,1,0,0|1,0,0]=3 11184 B16R2.11911 O=C1COC(=O)C1Oc2cccc(c2)Cl 34a_100000210295_100000032967 [0,1,0,1,0,0|1,0,0]=3 11185 B16R2.11911 O=C1COC(=O)C1Oc2cccc(c2)F 34a_100000210426_100000032967 [0,1,0,1,0,0|1,0,0]=3 11186 B16R2.11911 O=C1COC(=O)C1Oc2cccc(c2)I 34a_100000211634_100000032967 [0,1,0,1,0,0|1,0,0]=3 11187 B16R2.11911 O=C1COC(=O)C1Oc2cccc(n2)F 34a_100011432558_100000032967 [0,1,0,1,0,0|2,0,0]=4 11188 B16R2.11911 O=C1COC(=O)C1Oc2ccnc(c2)Cl 34a_100000762945_100000032967 [0,1,0,1,0,0|2,0,0]=4 11189 B16R2.11911 O=C1COC(=O)C1Oc2ccnc(c2)F 34a_100000732698_100000032967 [0,1,0,1,0,0|2,0,0]=4 11190 B16R2.11911 O=C1COC(=O)C1Oc2cncc(c2)Br 34a_100000754920_100000032967 [0,1,0,1,0,0|2,0,0]=4 11191 B16R2.11911 O=C1COC(=O)C1Oc2cncc(c2)F 34a_100011830296_100000032967 [0,1,0,1,0,0|2,0,0]=4 11192 B16R2.11911 O=C1COC(=O)C1Sc2cccc(c2)Br 62a_100000691529_100000032967 [0,1,0,1,0,0|1,1,0]=4 11193 B16R2.11911 O=C1COC(=O)C1Sc2cccc(c2)Cl 62a_100000699651_100000032967 [0,1,0,1,0,0|1,1,0]=4 11194 B16R2.11911 O=C1COC(=O)C1Sc2cccc(c2)F 62a_100000685547_100000032967 [0,1,0,1,0,0|1,1,0]=4 11195 B16R2.11911 O=C1COC(=O)C1Sc2cccc(c2)[S] 62a_114929384022_100000032967 [0,1,0,1,0,0|1,1,0]=4 11196 B16R2.11573 Cc1ccc(cc1)NC2C(=O)COC2=O 34a_100000124888_100000032967 [0,1,0,1,0,0|2,0,0]=4 11197 B16R2.11573 Cc1ccc(cc1)OC2C(=O)CCC2=O 7a_100000210336_100009820769 [0,1,0,1,0,0|2,0,0]=4 11198 B16R2.11573 Cc1ccc(cc1)OC2C(=O)COC2=O 34a_100000210336_100000032967 [0,1,0,1,0,0|1,0,0]=3 11199 B16R2.11573 Cc1ccc(cc1)SC2C(=O)COC2=O 62a_100000186775_100000032967 [0,1,0,1,0,0|1,1,0]=4 11200 B16R2.11573 Cc1ccc(cn1)OC2C(=O)COC2=O 34a_100000745506_100000032967 [0,1,0,1,0,0|2,0,0]=4 11201 B16R2.11573 Cc1ccc(nc1)OC2C(=O)COC2=O 34a_100000759353_100000032967 [0,1,0,1,0,0|2,0,0]=4 11202 B16R2.11573 Nc1ccc(cc1)OC2C(=O)COC2=O 34a_100000185829_100000032967 [0,1,0,1,0,0|1,0,0]=3 11203 B16R2.11573 Nc1ccc(cc1)SC2C(=O)COC2=O 62a_100000185761_100000032967 [0,1,0,1,0,0|1,1,0]=4 11204 B16R2.11573 Nc1ccc(cn1)OC2C(=O)COC2=O 34a_100015188713_100000032967 [0,1,0,1,0,0|2,0,0]=4 11205 B16R2.11573 Nc1ccc(nc1)OC2C(=O)COC2=O 34a_100000729260_100000032967 [0,1,0,1,0,0|2,0,0]=4 11206 B16R2.11573 O=C1CCC(=O)C1Oc2ccc(cc2)Br 7a_100000185759_100009820769 [0,1,0,1,0,0|2,0,0]=4 11207 B16R2.11573 O=C1CCC(=O)C1Oc2ccc(cc2)Cl 7a_100000210216_100009820769 [0,1,0,1,0,0|2,0,0]=4 11208 B16R2.11573 O=C1CCC(=O)C1Oc2ccc(cc2)I 7a_100000212066_100009820769 [0,1,0,1,0,0|2,0,0]=4 11209 B16R2.11573 O=C1COC(=O)C1Nc2ccc(cc2)Br 34a_100000210018_100000032967 [0,1,0,1,0,0|2,0,0]=4 11210 B16R2.11573 O=C1COC(=O)C1Nc2ccc(cc2)Cl 34a_100000210052_100000032967 [0,1,0,1,0,0|2,0,0]=4 11211 B16R2.11573 O=C1COC(=O)C1Nc2ccc(cc2)F 34a_100000185862_100000032967 [0,1,0,1,0,0|2,0,0]=4 11212 B16R2.11573 O=C1COC(=O)C1Nc2ccc(cc2)I 34a_100000185761_100000032967 [0,1,0,1,0,0|2,0,0]=4 11213 B16R2.11573 O=C1COC(=O)C1Nc2ccc(cc2)O 34a_100000185829_100000032967 [0,1,0,1,0,0|2,0,0]=4 11214 B16R2.11573 O=C1COC(=O)C1Oc2ccc(=O)[nH]c2 34a_100000075641_100000032967 [0,1,0,1,0,0|2,0,0]=4 11215 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cc2)Br 34a_100000185759_100000032967 [0,1,0,1,0,0|1,0,0]=3 11216 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cc2)Cl 34a_100000210216_100000032967 [0,1,0,1,0,0|1,0,0]=3 11217 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cc2)F 34a_100000210339_100000032967 [0,1,0,1,0,0|1,0,0]=3 11218 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cc2)I 34a_100000212066_100000032967 [0,1,0,1,0,0|1,0,0]=3 11219 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cn2)Cl 34a_100011215309_100000032967 [0,1,0,1,0,0|2,0,0]=4 11220 B16R2.11573 O=C1COC(=O)C1Oc2ccc(cn2)F 34a_100000742473_100000032967 [0,1,0,1,0,0|2,0,0]=4 11221 B16R2.11573 O=C1COC(=O)C1Oc2ccc(nc2)Br 34a_100000685995_100000032967 [0,1,0,1,0,0|2,0,0]=4 11222 B16R2.11573 O=C1COC(=O)C1Oc2ccc(nc2)Cl 34a_100000744096_100000032967 [0,1,0,1,0,0|2,0,0]=4 11223 B16R2.11573 O=C1COC(=O)C1Oc2ccc(nc2)F 34a_100000688820_100000032967 [0,1,0,1,0,0|2,0,0]=4 11224 B16R2.11573 O=C1COC(=O)C1Oc2ccc(nc2)I 34a_100000687607_100000032967 [0,1,0,1,0,0|2,0,0]=4 11225 B16R2.11573 O=C1COC(=O)C1Sc2ccc(cc2)Br 62a_100000752885_100000032967 [0,1,0,1,0,0|1,1,0]=4 11226 B16R2.11573 O=C1COC(=O)C1Sc2ccc(cc2)Cl 62a_100000755918_100000032967 [0,1,0,1,0,0|1,1,0]=4 11227 B16R2.11573 O=C1COC(=O)C1Sc2ccc(cc2)F 62a_100000211213_100000032967 [0,1,0,1,0,0|1,1,0]=4 11228 B16R2.1056 C=CCOc1cc2ccccc2oc1=O 7a_100000061252_100015514636 [0,1,0,1,0,0|1,0,1]=4 11229 B16R2.2128 C=CCCC(=O)C1Cc2ccccc2C1 1458a_100000685393_100000754431 [0,1,0,1,0,0|2,0,0]=4 11230 B16R2.2128 C=CCCC(=O)C1Cc2ccccc2C1 1458a_100000749702_100000753484 [0,1,0,1,0,0|2,0,0]=4 11231 B16R2.2128 C=CCCC(=O)C1Cc2ccccc2O1 1458a_100000209886_100000754431 [0,1,0,1,0,0|1,0,0]=3 11232 B16R2.2128 C=CCCC(=O)C1Cc2ccccc2S1 1458a_100000024912_100000754431 [0,1,0,1,0,0|1,1,0]=4 11233 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2C1 1626a_100020586998_100000685393 [0,1,0,1,0,0|2,0,0]=4 11234 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2C1 240690a_100020586998_100000685393 [0,1,0,1,0,0|2,0,0]=4 11235 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2C1 527a_100020586998_100000685393 [0,1,0,1,0,0|2,0,0]=4 11236 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2O1 1626a_100020586998_100000209886 [0,1,0,1,0,0|1,0,0]=3 11237 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2O1 240690a_100020586998_100000209886 [0,1,0,1,0,0|1,0,0]=3 11238 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2O1 527a_100020586998_100000209886 [0,1,0,1,0,0|1,0,0]=3 11239 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2S1 1626a_100020586998_100000024912 [0,1,0,1,0,0|1,1,0]=4 11240 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2S1 240690a_100020586998_100000024912 [0,1,0,1,0,0|1,1,0]=4 11241 B16R2.2128 C=CCNC(=O)C1Cc2ccccc2S1 527a_100020586998_100000024912 [0,1,0,1,0,0|1,1,0]=4 11242 B16R2.767 C=CCC(=O)C1=Cc2ccccc2OC1 1458a_100000018039_100000210623 [0,1,0,1,0,0|2,0,0]=4 11243 B16R2.3322 C=C1CC(C1)C(=O)CCc2ccccc2 1458a_100000065620_100000765856 [0,1,0,1,0,0|2,0,0]=4 11244 B16R2.249491 C=CCN(C)C(=O)C1Cc2c1cccc2 11a_100000225617_200000238571 [0,1,0,1,0,0|2,0,0]=4 11245 B16R2.249491 C=CCN(C)C(=O)C1Cc2c1cccc2 1626a_100000225617_200000238571 [0,1,0,1,0,0|2,0,0]=4 11246 B16R2.249491 C=CCN(C)C(=O)C1Cc2c1cccc2 240690a_100000225617_200000238571 [0,1,0,1,0,0|2,0,0]=4 11247 B16R2.249491 C=CCN(C)C(=O)C1Cc2c1cccc2 527a_100000225617_200000238571 [0,1,0,1,0,0|2,0,0]=4 11248 B16R2.14689 Cc1ccccc1NC2C(=O)COC2=O 34a_100015192222_100000032967 [0,1,0,1,0,0|2,0,0]=4 11249 B16R2.14689 Cc1ccccc1OC2C(=O)CCC2=O 7a_100000210338_100009820769 [0,1,0,1,0,0|2,0,0]=4 11250 B16R2.14689 Cc1ccccc1OC2C(=O)COC2=O 34a_100000210338_100000032967 [0,1,0,1,0,0|1,0,0]=3 11251 B16R2.14689 Cc1ccccc1SC2C(=O)COC2=O 62a_100000210755_100000032967 [0,1,0,1,0,0|1,1,0]=4 11252 B16R2.14689 Cc1ccncc1OC2C(=O)COC2=O 34a_100011997053_100000032967 [0,1,0,1,0,0|2,0,0]=4 11253 B16R2.14689 Cc1cnccc1OC2C(=O)COC2=O 34a_100000694293_100000032967 [0,1,0,1,0,0|2,0,0]=4 11254 B16R2.14689 Cc1ncccc1OC2C(=O)COC2=O 34a_100000745507_100000032967 [0,1,0,1,0,0|2,0,0]=4 11255 B16R2.14689 Nc1ccccc1OC2C(=O)CCC2=O 7a_100000185747_100009820769 [0,1,0,1,0,0|2,0,0]=4 11256 B16R2.14689 Nc1ccccc1OC2C(=O)COC2=O 34a_100000185747_100000032967 [0,1,0,1,0,0|1,0,0]=3 11257 B16R2.14689 Nc1ccccc1SC2C(=O)COC2=O 62a_100000210017_100000032967 [0,1,0,1,0,0|1,1,0]=4 11258 B16R2.14689 Nc1cccnc1OC2C(=O)COC2=O 34a_100000746358_100000032967 [0,1,0,1,0,0|2,0,0]=4 11259 B16R2.14689 Nc1ccncc1OC2C(=O)COC2=O 34a_100000753702_100000032967 [0,1,0,1,0,0|2,0,0]=4 11260 B16R2.14689 Nc1ncccc1OC2C(=O)COC2=O 34a_100000211975_100000032967 [0,1,0,1,0,0|2,0,0]=4 11261 B16R2.14689 O=C1CCC(=O)C1Oc2ccccc2Br 7a_100000181306_100009820769 [0,1,0,1,0,0|2,0,0]=4 11262 B16R2.14689 O=C1CCC(=O)C1Oc2ccccc2Cl 7a_100000210172_100009820769 [0,1,0,1,0,0|2,0,0]=4 11263 B16R2.14689 O=C1CCC(=O)C1Oc2ccccc2F 7a_100000210171_100009820769 [0,1,0,1,0,0|2,0,0]=4 11264 B16R2.14689 O=C1CCC(=O)C1Oc2ccccc2I 7a_100000739446_100009820769 [0,1,0,1,0,0|2,0,0]=4 11265 B16R2.14689 O=C1COC(=O)C1Nc2ccccc2Br 34a_100000210017_100000032967 [0,1,0,1,0,0|2,0,0]=4 11266 B16R2.14689 O=C1COC(=O)C1Nc2ccccc2Cl 34a_100000185783_100000032967 [0,1,0,1,0,0|2,0,0]=4 11267 B16R2.14689 O=C1COC(=O)C1Nc2ccccc2F 34a_100000210422_100000032967 [0,1,0,1,0,0|2,0,0]=4 11268 B16R2.14689 O=C1COC(=O)C1Nc2ccccc2I 34a_100000210053_100000032967 [0,1,0,1,0,0|2,0,0]=4 11269 B16R2.14689 O=C1COC(=O)C1Nc2ccccc2O 34a_100000185747_100000032967 [0,1,0,1,0,0|2,0,0]=4 11270 B16R2.14689 O=C1COC(=O)C1Oc2ccccc2Br 34a_100000181306_100000032967 [0,1,0,1,0,0|1,0,0]=3 11271 B16R2.14689 O=C1COC(=O)C1Oc2ccccc2Cl 34a_100000210172_100000032967 [0,1,0,1,0,0|1,0,0]=3 11272 B16R2.14689 O=C1COC(=O)C1Oc2ccccc2F 34a_100000210171_100000032967 [0,1,0,1,0,0|1,0,0]=3 11273 B16R2.14689 O=C1COC(=O)C1Oc2ccccc2I 34a_100000739446_100000032967 [0,1,0,1,0,0|1,0,0]=3 11274 B16R2.14689 O=C1COC(=O)C1Oc2cccnc2Br 34a_100000744436_100000032967 [0,1,0,1,0,0|2,0,0]=4 11275 B16R2.14689 O=C1COC(=O)C1Oc2cccnc2Cl 34a_100000757616_100000032967 [0,1,0,1,0,0|2,0,0]=4 11276 B16R2.14689 O=C1COC(=O)C1Oc2cccnc2F 34a_100000061740_100000032967 [0,1,0,1,0,0|2,0,0]=4 11277 B16R2.14689 O=C1COC(=O)C1Oc2cccnc2I 34a_100000034122_100000032967 [0,1,0,1,0,0|2,0,0]=4 11278 B16R2.14689 O=C1COC(=O)C1Oc2cccoc2=O 34a_100000077404_100000032967 [0,1,0,1,0,0|2,0,0]=4 11279 B16R2.14689 O=C1COC(=O)C1Oc2ccncc2Br 34a_100011996408_100000032967 [0,1,0,1,0,0|2,0,0]=4 11280 B16R2.14689 O=C1COC(=O)C1Oc2ccncc2Cl 34a_100011997054_100000032967 [0,1,0,1,0,0|2,0,0]=4 11281 B16R2.14689 O=C1COC(=O)C1Oc2ccncc2F 34a_200000081243_100000032967 [0,1,0,1,0,0|2,0,0]=4 11282 B16R2.14689 O=C1COC(=O)C1Oc2cnccc2Cl 34a_100011996695_100000032967 [0,1,0,1,0,0|2,0,0]=4 11283 B16R2.14689 O=C1COC(=O)C1Oc2cnccc2I 34a_100000050107_100000032967 [0,1,0,1,0,0|2,0,0]=4 11284 B16R2.14689 O=C1COC(=O)C1Oc2coccc2=O 34a_100000060831_100000032967 [0,1,0,1,0,0|2,0,0]=4 11285 B16R2.14689 O=C1COC(=O)C1Oc2ncccc2Cl 34a_100011290957_100000032967 [0,1,0,1,0,0|2,0,0]=4 11286 B16R2.14689 O=C1COC(=O)C1Oc2ncccc2F 34a_100011219419_100000032967 [0,1,0,1,0,0|2,0,0]=4 11287 B16R2.14689 O=C1COC(=O)C1Sc2ccccc2Br 62a_100000695589_100000032967 [0,1,0,1,0,0|1,1,0]=4 11288 B16R2.14689 O=C1COC(=O)C1Sc2ccccc2Cl 62a_100000764095_100000032967 [0,1,0,1,0,0|1,1,0]=4 11289 B16R2.14689 O=C1COC(=O)C1Sc2ccccc2F 62a_100011215700_100000032967 [0,1,0,1,0,0|1,1,0]=4 11290 B16R2.14689 O=C1COC(=O)C1Sc2ccccc2O 62a_100000739446_100000032967 [0,1,0,1,0,0|1,1,0]=4 11291 B16R2.2942 C=CCOC1CCc2ccccc2C1=O 34a_200000210373_100000229917 [0,1,0,1,0,0|1,0,1]=4 11292 B16R2.2942 C=CCSc1coc2ccccc2c1=O 62a_100000210623_100009813851 [0,1,0,1,0,0|0,1,1]=4 11293 B16R2.333 CC(=O)CN1C(=O)COc2c1cccc2 1458a_100000181424_200000210301 [0,1,0,1,0,0|1,0,1]=4 11294 B16R2.333 [13CH3]C(=O)CN1C(=O)COc2c1cccc2 1458a_100000181424_200025704644 [0,1,0,1,0,0|1,0,1]=4 11295 B16R2.249076 C=C(C)CCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000730704 [0,1,0,1,0,0|2,0,0]=4 11296 B16R2.249076 C=C(C)CNC(=O)C1Cc2c1cccc2 11a_100000765925_200000238571 [0,1,0,1,0,0|2,0,0]=4 11297 B16R2.249076 C=C(C)CNC(=O)C1Cc2c1cccc2 1626a_100000765925_200000238571 [0,1,0,1,0,0|2,0,0]=4 11298 B16R2.249076 C=C(C)CNC(=O)C1Cc2c1cccc2 240690a_100000765925_200000238571 [0,1,0,1,0,0|2,0,0]=4 11299 B16R2.249076 C=C(C)CNC(=O)C1Cc2c1cccc2 527a_100000765925_200000238571 [0,1,0,1,0,0|2,0,0]=4 11300 B12R0.103 C=CC=CC(=O)CC(=O)NCC=C 1458a_100016291481_100000183597 [0,0,1,0,1,0|2,0,0]=4 11301 B12R0.103 C=CC=CC(=O)CC(=O)OCC=C 1458a_100016291481_100000033060 [0,0,1,0,1,0|1,0,0]=3 11302 B12R1.32 C#CCC(=O)Cc1ccccc1 1458a_100011220946_100015291786 [1,0,0,0,1,0|0,0,2]=4 11303 B12R1.32 C=CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210623 [1,0,0,0,1,0|1,0,0]=3 11304 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [1,0,0,0,1,0|0,0,0]=2 11305 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000210193_100000721315 [1,0,0,0,1,0|1,0,0]=3 11306 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000233486_100000210623 [1,0,0,0,1,0|1,0,0]=3 11307 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000210193_100000733263 [1,0,0,0,1,0|1,0,0]=3 11308 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000737805_100000210623 [1,0,0,0,1,0|1,0,0]=3 11309 B12R1.32 C=CCC(=O)Cc1cccnn1 1458a_100000210193_100016990269 [1,0,0,0,1,0|2,0,0]=4 11310 B12R1.32 C=CCC(=O)Cc1ccncc1 1458a_100000210193_100000705612 [1,0,0,0,1,0|1,0,0]=3 11311 B12R1.32 C=CCC(=O)Cc1cnccn1 1458a_100000210193_100016995436 [1,0,0,0,1,0|2,0,0]=4 11312 B12R1.32 C=CCC(=O)Cc1cncnc1 1458a_100000210193_100015196519 [1,0,0,0,1,0|2,0,0]=4 11313 B12R1.32 C=CCC(=O)Cc1cncnc1 1458a_100000721575_100000210623 [1,0,0,0,1,0|2,0,0]=4 11314 B12R1.32 C=CCC(=O)Cc1ncccn1 1458a_100000210193_100000703007 [1,0,0,0,1,0|2,0,0]=4 11315 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [1,0,0,0,1,0|1,0,0]=3 11316 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [1,0,0,0,1,0|1,0,0]=3 11317 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [1,0,0,0,1,0|1,0,0]=3 11318 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [1,0,0,0,1,0|1,0,0]=3 11319 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000186898_100000210623 [1,0,0,0,1,0|2,0,0]=4 11320 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000196212_200000210301 [1,0,0,0,1,0|2,0,0]=4 11321 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000225617_100015291786 [1,0,0,0,1,0|2,0,0]=4 11322 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000186898_100000210623 [1,0,0,0,1,0|2,0,0]=4 11323 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000196212_200000210301 [1,0,0,0,1,0|2,0,0]=4 11324 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000225617_100000211182 [1,0,0,0,1,0|2,0,0]=4 11325 B12R1.32 C=CCN(C)Cc1ccccc1 270004a_100000225617_100015611070 [1,0,0,0,1,0|2,0,0]=4 11326 B12R1.32 C=CCN([13CH3])Cc1ccccc1 2230a_100000196212_200025704644 [1,0,0,0,1,0|2,0,0]=4 11327 B12R1.32 C=CCN([13CH3])Cc1ccccc1 269982a_100000196212_200025704644 [1,0,0,0,1,0|2,0,0]=4 11328 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [1,0,0,0,1,0|0,0,2]=4 11329 B12R1.32 CCCC(=O)Cc1ccccc1 1458a_100000211992_100015291786 [1,0,0,0,1,0|0,0,2]=4 11330 B12R1.32 CNCC(=O)Cc1ccccc1 2230a_106832991635_100000233483 [1,0,0,0,1,0|1,0,1]=4 11331 B12R1.32 CNCC(=O)Cc1ccccc1 7a_106832991635_100000233483 [1,0,0,0,1,0|1,0,1]=4 11332 B12R1.32 CNCC(=O)Oc1ccccc1 2230a_106832991635_100009813826 [1,0,0,0,1,0|1,0,1]=4 11333 B12R1.32 CNCC(=O)Oc1ccccc1 34a_100102657272_100009813826 [1,0,0,0,1,0|1,0,1]=4 11334 B12R1.32 CNCC(=O)Oc1ccccc1 7a_106832991635_100009813826 [1,0,0,0,1,0|1,0,1]=4 11335 B12R1.32 COCC(=O)Cc1ccccc1 1458a_100000210968_100015291786 [1,0,0,0,1,0|1,0,1]=4 11336 B12R1.32 COCC(=O)Oc1ccccc1 34a_100138415774_100009813826 [1,0,0,0,1,0|1,0,1]=4 11337 B12R1.32 CSCC(=O)Cc1ccccc1 1458a_100000184570_100015291786 [1,0,0,0,1,0|1,0,1]=4 11338 B12R1.32 CSCC(=O)Cc1ccccc1 62a_100000233483_200000210301 [1,0,0,0,1,0|1,0,1]=4 11339 B12R1.32 CSCC(=O)Cc1ccccc1 62a_200000210301_100000233483 [1,0,0,0,1,0|1,0,1]=4 11340 B12R1.32 CSCC(=O)Oc1ccccc1 62a_100009813826_200000210301 [1,0,0,0,1,0|1,0,1]=4 11341 B12R1.32 CSCC(=O)Oc1ccccc1 62a_200000210301_100009813826 [1,0,0,0,1,0|1,0,1]=4 11342 B12R1.32 N#CCC(=O)Cc1ccccc1 1458a_100051588842_100015291786 [1,0,0,0,1,0|1,0,1]=4 11343 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [1,0,0,0,1,0|1,0,1]=4 11344 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [1,0,0,0,1,0|1,0,1]=4 11345 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [1,0,0,0,1,0|1,0,1]=4 11346 B12R1.32 O=C(CCO)Cc1ccccc1 1458a_100011216618_100015291786 [1,0,0,0,1,0|1,0,1]=4 11347 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_100000233483_200025704644 [1,0,0,0,1,0|1,0,1]=4 11348 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_200025704644_100000233483 [1,0,0,0,1,0|1,0,1]=4 11349 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_100009813826_200025704644 [1,0,0,0,1,0|1,0,1]=4 11350 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_200025704644_100009813826 [1,0,0,0,1,0|1,0,1]=4 11351 B12R1.51 C=CCC(=O)CCc1cc[nH]c1 1458a_200000093579_100000210623 [1,0,0,0,1,0|2,0,0]=4 11352 B12R1.51 C=CCC(=O)CCc1ccc[nH]1 1458a_200011998680_100000210623 [1,0,0,0,1,0|2,0,0]=4 11353 B12R1.51 C=CCC(=O)CCc1ccco1 1458a_100000185103_100000210623 [1,0,0,0,1,0|2,0,0]=4 11354 B12R1.51 C=CCC(=O)CCc1cccs1 1458a_100000185280_100000210623 [1,0,0,0,1,0|2,0,0]=4 11355 B12R1.51 C=CCC(=O)CCc1cccs1 1458a_100000210193_100000748579 [1,0,0,0,1,0|2,0,0]=4 11356 B12R1.51 C=CCC(=O)CCc1ccsc1 1458a_100000195497_100000210623 [1,0,0,0,1,0|2,0,0]=4 11357 B12R1.51 C=CCC(=O)CCn1cccc1 1458a_100000210193_200000035178 [1,0,0,0,1,0|2,0,0]=4 11358 B12R1.51 C=CCC(=O)CCn1cccc1 1458a_100011196273_100000210623 [1,0,0,0,1,0|2,0,0]=4 11359 B12R1.51 C=COC(=O)COc1ccsc1 34a_100000106738_100000036128 [1,0,0,0,1,0|1,0,0]=3 11360 B12R1.51 C=COC(=O)CSc1ccco1 62a_100000036128_100009814098 [1,0,0,0,1,0|1,1,0]=4 11361 B12R1.51 C=COC(=O)CSc1ccco1 62a_100009814098_100000036128 [1,0,0,0,1,0|1,1,0]=4 11362 B12R1.51 C=COC(=O)CSc1cccs1 62a_100000036128_100011215356 [1,0,0,0,1,0|1,1,0]=4 11363 B12R1.51 C=COC(=O)CSc1cccs1 62a_100011215356_100000036128 [1,0,0,0,1,0|1,1,0]=4 11364 B12R1.51 C=COC(=O)CSc1ccoc1 62a_100000036128_100011215275 [1,0,0,0,1,0|1,1,0]=4 11365 B12R1.51 C=COC(=O)CSc1ccoc1 62a_100011215275_100000036128 [1,0,0,0,1,0|1,1,0]=4 11366 B12R1.51 C=COC(=O)CSc1ccsc1 62a_100000036128_100000738268 [1,0,0,0,1,0|1,1,0]=4 11367 B12R1.51 C=COC(=O)CSc1ccsc1 62a_100000738268_100000036128 [1,0,0,0,1,0|1,1,0]=4 11368 B12R1.51 CCOC(=O)COc1ccsc1 34a_100000106738_100000188475 [1,0,0,0,1,0|1,0,1]=4 11369 B12R1.51 CCOC(=O)COc1ccsc1 7a_100000106738_100000188475 [1,0,0,0,1,0|1,0,1]=4 11370 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [0,0,0,0,2,0|1,0,0]=3 11371 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [0,0,0,0,2,0|1,0,0]=3 11372 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [0,0,0,0,2,0|1,0,0]=3 11373 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [0,0,0,0,2,0|1,0,0]=3 11374 B12R1.30 C=CCOC(C)c1ccccc1 34a_200000210373_100000211855 [0,0,0,0,2,0|1,0,1]=4 11375 B12R1.30 C=CCO[C@H](C)c1ccccc1 34a_100000761318_100015514636 [0,0,0,0,2,0|1,0,1]=4 11376 B12R1.30 C=CCO[C@H](C)c1ccccc1 7a_100000761318_100015514636 [0,0,0,0,2,0|1,0,1]=4 11377 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [0,0,0,0,2,0|1,0,1]=4 11378 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [0,0,0,0,2,0|1,0,1]=4 11379 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [0,0,0,0,2,0|1,0,1]=4 11380 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [0,0,0,0,2,0|1,0,1]=4 11381 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [0,0,0,0,2,0|1,0,1]=4 11382 B12R1.53 C=CCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000754431 [0,0,0,0,2,0|2,0,0]=4 11383 B12R1.53 C=CCCC(=O)Cc1ccco1 1458a_100011217309_100000754431 [0,0,0,0,2,0|2,0,0]=4 11384 B12R1.53 C=CCCC(=O)Cc1cccs1 1458a_100000210189_100000754431 [0,0,0,0,2,0|2,0,0]=4 11385 B12R1.53 C=CCCC(=O)Cc1ccoc1 1458a_100000684892_100000754431 [0,0,0,0,2,0|2,0,0]=4 11386 B12R1.53 C=CCCC(=O)Cc1ccsc1 1458a_100000184062_100000754431 [0,0,0,0,2,0|2,0,0]=4 11387 B12R1.53 C=CCCC(=O)Cc1ccsc1 1458a_100000749702_100011233845 [0,0,0,0,2,0|2,0,0]=4 11388 B12R1.53 C=CCCC(=O)Cn1cccc1 1458a_100011196272_100000754431 [0,0,0,0,2,0|2,0,0]=4 11389 B12R1.53 C=CCNC(=O)Cc1ccc[nH]1 240690a_100020586998_100000238377 [0,0,0,0,2,0|2,0,0]=4 11390 B12R1.53 C=CCNC(=O)Cc1ccc[nH]1 527a_100020586998_100000238377 [0,0,0,0,2,0|2,0,0]=4 11391 B12R1.53 C=CCNC(=O)Cc1ccco1 527a_100020586998_100011217309 [0,0,0,0,2,0|2,0,0]=4 11392 B12R1.53 C=CCNC(=O)Cc1cccs1 1626a_100020586998_100000210189 [0,0,0,0,2,0|2,0,0]=4 11393 B12R1.53 C=CCNC(=O)Cc1cccs1 240690a_100020586998_100000210189 [0,0,0,0,2,0|2,0,0]=4 11394 B12R1.53 C=CCNC(=O)Cc1ccoc1 1626a_100020586998_100000684892 [0,0,0,0,2,0|2,0,0]=4 11395 B12R1.53 C=CCNC(=O)Cc1ccoc1 240690a_100020586998_100000684892 [0,0,0,0,2,0|2,0,0]=4 11396 B12R1.53 C=CCNC(=O)Cc1ccoc1 527a_100020586998_100000684892 [0,0,0,0,2,0|2,0,0]=4 11397 B12R1.53 C=CCNC(=O)Cc1ccsc1 1626a_100020586998_100000184062 [0,0,0,0,2,0|2,0,0]=4 11398 B12R1.53 C=CCNC(=O)Cc1ccsc1 240690a_100020586998_100000184062 [0,0,0,0,2,0|2,0,0]=4 11399 B12R1.53 C=CCNC(=O)Cc1ccsc1 527a_100020586998_100000184062 [0,0,0,0,2,0|2,0,0]=4 11400 B12R1.53 C=CCNC(=O)Cn1cccc1 1626a_100020586998_100011196272 [0,0,0,0,2,0|2,0,0]=4 11401 B12R1.53 C=CCNC(=O)Cn1cccc1 527a_100020586998_100011196272 [0,0,0,0,2,0|2,0,0]=4 11402 B16R1.1465 C=CC=CC(=O)CCCOc1ccccc1 1458a_100016291481_100000199009 [0,0,0,0,0,2|1,0,1]=4 11403 B16R1.1465 C=CC=CC(=O)CCOCc1ccccc1 1458a_100016291481_100000234347 [0,0,0,0,0,2|1,0,1]=4 11404 B16R1.1465 C=CC=CC(=O)NCCOc1ccccc1 1626a_100000174943_100016291481 [0,0,0,0,0,2|1,0,1]=4 11405 B16R1.1465 C=CCCC(=O)C=CCCc1ccccc1 1458a_100016484021_100000754431 [0,0,0,0,0,2|2,0,0]=4 11406 B16R1.1465 C=CCCC(=O)CCCCc1ccccc1 1458a_100000749702_100000701786 [0,0,0,0,0,2|2,0,0]=4 11407 B16R1.1465 C=CCCC(=O)CCCCc1ccccc1 1458a_100011215911_100000754431 [0,0,0,0,0,2|2,0,0]=4 11408 B16R1.1465 C=CCCC(=O)CCCOc1ccccc1 1458a_100000212059_100000754431 [0,0,0,0,0,2|1,0,0]=3 11409 B16R1.1465 C=CCCC(=O)CCCOc1ccccc1 1458a_100000749702_100000199009 [0,0,0,0,0,2|1,0,0]=3 11410 B16R1.1465 C=CCCC(=O)CCCSc1ccccc1 1458a_100000182835_100000754431 [0,0,0,0,0,2|1,1,0]=4 11411 B16R1.1465 C=CCCC(=O)CCCSc1ccccc1 1458a_100000749702_200011203293 [0,0,0,0,0,2|1,1,0]=4 11412 B16R1.1465 C=CCCC(=O)CCOCc1ccccc1 1458a_100000743319_100000754431 [0,0,0,0,0,2|1,0,0]=3 11413 B16R1.1465 C=CCCC(=O)CCOCc1ccccc1 1458a_100000749702_100000234347 [0,0,0,0,0,2|1,0,0]=3 11414 B16R1.1465 C=CCCC(=O)CCSCc1ccccc1 1458a_100000173759_100000754431 [0,0,0,0,0,2|1,1,0]=4 11415 B16R1.1465 C=CCCC(=O)CCSCc1ccccc1 1458a_100000749702_200011297719 [0,0,0,0,0,2|1,1,0]=4 11416 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 11a_100020603302_100000749702 [0,0,0,0,0,2|2,0,0]=4 11417 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 1626a_100020603302_100000749702 [0,0,0,0,0,2|2,0,0]=4 11418 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 240690a_100020603302_100000749702 [0,0,0,0,0,2|2,0,0]=4 11419 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 527a_100020603302_100000749702 [0,0,0,0,0,2|2,0,0]=4 11420 B16R1.1465 C=CCCC(=O)NCC#Cc1ccccc1 11a_100000735379_100000749702 [0,0,0,0,0,2|2,0,0]=4 11421 B16R1.1465 C=CCCC(=O)NCC#Cc1ccccc1 1626a_100000735379_100000749702 [0,0,0,0,0,2|2,0,0]=4 11422 B16R1.1465 C=CCCC(=O)NCC#Cc1ccccc1 240690a_100000735379_100000749702 [0,0,0,0,0,2|2,0,0]=4 11423 B16R1.1465 C=CCCC(=O)NCC#Cc1ccccc1 527a_100000735379_100000749702 [0,0,0,0,0,2|2,0,0]=4 11424 B16R1.1465 C=CCCC(=O)NCCCc1ccccc1 11a_100000211184_100000749702 [0,0,0,0,0,2|2,0,0]=4 11425 B16R1.1465 C=CCCC(=O)NCCCc1ccccc1 1626a_100000211184_100000749702 [0,0,0,0,0,2|2,0,0]=4 11426 B16R1.1465 C=CCCC(=O)NCCCc1ccccc1 240690a_100000211184_100000749702 [0,0,0,0,0,2|2,0,0]=4 11427 B16R1.1465 C=CCCC(=O)NCCCc1ccccc1 527a_100000211184_100000749702 [0,0,0,0,0,2|2,0,0]=4 11428 B16R1.1465 C=CCCC(=O)NCCOc1ccccc1 11a_100000174943_100000749702 [0,0,0,0,0,2|1,0,0]=3 11429 B16R1.1465 C=CCCC(=O)NCCOc1ccccc1 1626a_100000174943_100000749702 [0,0,0,0,0,2|1,0,0]=3 11430 B16R1.1465 C=CCCC(=O)NCCOc1ccccc1 240690a_100000174943_100000749702 [0,0,0,0,0,2|1,0,0]=3 11431 B16R1.1465 C=CCCC(=O)NCCOc1ccccc1 527a_100000174943_100000749702 [0,0,0,0,0,2|1,0,0]=3 11432 B16R1.1465 C=CCCC(=O)NCCOc1ccccn1 11a_106741647558_100000749702 [0,0,0,0,0,2|2,0,0]=4 11433 B16R1.1465 C=CCCC(=O)NCCOc1ccccn1 1626a_106741647558_100000749702 [0,0,0,0,0,2|2,0,0]=4 11434 B16R1.1465 C=CCCC(=O)NCCOc1ccccn1 240690a_106741647558_100000749702 [0,0,0,0,0,2|2,0,0]=4 11435 B16R1.1465 C=CCCC(=O)NCCOc1ccccn1 527a_106741647558_100000749702 [0,0,0,0,0,2|2,0,0]=4 11436 B16R1.1465 C=CCCC(=O)NCCOc1cccnc1 11a_100000754688_100000749702 [0,0,0,0,0,2|2,0,0]=4 11437 B16R1.1465 C=CCCC(=O)NCCOc1cccnc1 240690a_100000754688_100000749702 [0,0,0,0,0,2|2,0,0]=4 11438 B16R1.1465 C=CCCC(=O)NCCOc1cccnc1 527a_100000754688_100000749702 [0,0,0,0,0,2|2,0,0]=4 11439 B16R1.1465 C=CCCC(=O)NCCOc1ccncc1 11a_100025717301_100000749702 [0,0,0,0,0,2|2,0,0]=4 11440 B16R1.1465 C=CCCC(=O)NCCOc1ccncc1 240690a_100025717301_100000749702 [0,0,0,0,0,2|2,0,0]=4 11441 B16R1.1465 C=CCCC(=O)NCCOc1ccncc1 527a_100025717301_100000749702 [0,0,0,0,0,2|2,0,0]=4 11442 B16R1.1465 C=CCCC(=O)NCCSc1ccccc1 240690a_100000189519_100000749702 [0,0,0,0,0,2|1,1,0]=4 11443 B16R1.1465 C=CCCC(=O)NCCSc1ccccc1 527a_100000189519_100000749702 [0,0,0,0,0,2|1,1,0]=4 11444 B16R1.1465 C=CCCC(=O)NNCCc1ccccc1 22a_100000740470_100000749702 [0,0,0,0,0,2|2,0,0]=4 11445 B16R1.1465 C=CCNC(=O)C=CCCc1ccccc1 1626a_100020586998_100016484021 [0,0,0,0,0,2|2,0,0]=4 11446 B16R1.1465 C=CCNC(=O)C=CCCc1ccccc1 240690a_100020586998_100016484021 [0,0,0,0,0,2|2,0,0]=4 11447 B16R1.1465 C=CCNC(=O)CCCCc1ccccc1 1626a_100020586998_100011215911 [0,0,0,0,0,2|2,0,0]=4 11448 B16R1.1465 C=CCNC(=O)CCCCc1ccccc1 240690a_100020586998_100011215911 [0,0,0,0,0,2|2,0,0]=4 11449 B16R1.1465 C=CCNC(=O)CCCCc1ccccc1 527a_100020586998_100011215911 [0,0,0,0,0,2|2,0,0]=4 11450 B16R1.1465 C=CCNC(=O)CCCOc1ccccc1 1626a_100020586998_100000212059 [0,0,0,0,0,2|1,0,0]=3 11451 B16R1.1465 C=CCNC(=O)CCCOc1ccccc1 240690a_100020586998_100000212059 [0,0,0,0,0,2|1,0,0]=3 11452 B16R1.1465 C=CCNC(=O)CCCOc1ccccc1 527a_100020586998_100000212059 [0,0,0,0,0,2|1,0,0]=3 11453 B16R1.1465 C=CCNC(=O)CCCSc1ccccc1 1626a_100020586998_100000182835 [0,0,0,0,0,2|1,1,0]=4 11454 B16R1.1465 C=CCNC(=O)CCCSc1ccccc1 240690a_100020586998_100000182835 [0,0,0,0,0,2|1,1,0]=4 11455 B16R1.1465 C=CCNC(=O)CCCSc1ccccc1 527a_100020586998_100000182835 [0,0,0,0,0,2|1,1,0]=4 11456 B16R1.1465 C=CCNC(=O)CCNCc1ccccc1 2230a_100015324214_100011222895 [0,0,0,0,0,2|2,0,0]=4 11457 B16R1.1465 C=CCNC(=O)CCOCc1ccccc1 1626a_100020586998_100000743319 [0,0,0,0,0,2|1,0,0]=3 11458 B16R1.1465 C=CCNC(=O)CCOCc1ccccc1 240690a_100020586998_100000743319 [0,0,0,0,0,2|1,0,0]=3 11459 B16R1.1465 C=CCNC(=O)CCOCc1ccccc1 527a_100020586998_100000743319 [0,0,0,0,0,2|1,0,0]=3 11460 B16R1.1465 C=CCNC(=O)CCOCc1ccccc1 7a_100000210790_100011222895 [0,0,0,0,0,2|1,0,0]=3 11461 B16R1.1465 C=CCNC(=O)CCSCc1ccccc1 1626a_100020586998_100000173759 [0,0,0,0,0,2|1,1,0]=4 11462 B16R1.1465 C=CCNC(=O)CCSCc1ccccc1 240690a_100020586998_100000173759 [0,0,0,0,0,2|1,1,0]=4 11463 B16R1.1465 C=CCNC(=O)CCSCc1ccccc1 527a_100020586998_100000173759 [0,0,0,0,0,2|1,1,0]=4 11464 B16R1.1465 C=CCNC(=O)CCSCc1ccccc1 62a_100000211182_100011222895 [0,0,0,0,0,2|1,1,0]=4 11465 B16R1.1465 C=CCNC(=O)CCSCc1ccccc1 62a_100011222895_100015291786 [0,0,0,0,0,2|1,1,0]=4 11466 B16R1.1465 C=CCNC(=O)CNCCc1ccccc1 2230a_100000106460_100000183597 [0,0,0,0,0,2|2,0,0]=4 11467 B16R1.1465 C=CCNC(=O)COCCc1ccccc1 7a_100000210268_100000183597 [0,0,0,0,0,2|1,0,0]=3 11468 B16R1.1465 C=CCNC(=O)CSCCc1ccccc1 62a_100000183597_100011218657 [0,0,0,0,0,2|1,1,0]=4 11469 B16R1.1465 C=CCNC(=O)CSCCc1ccccc1 62a_100000765856_100000183597 [0,0,0,0,0,2|1,1,0]=4 11470 B16R1.1465 C=CCNC(=O)CSCSc1ccccc1 62a_100000183597_100011218342 [0,0,0,0,0,2|1,1,0]=4 11471 B16R1.1465 C=CCNC(=O)CSCSc1ccccc1 62a_100011218342_100000183597 [0,0,0,0,0,2|1,1,0]=4 11472 B16R1.1465 C=CCNC(=O)NC/C=C/c1ccccc1 2708a_100020603302_100020586998 [0,0,0,0,0,2|2,0,0]=4 11473 B16R1.1465 C=CCNC(=O)NC/C=C/c1ccccc1 273464a_100020586998_100020603302 [0,0,0,0,0,2|2,0,0]=4 11474 B16R1.1465 C=CCNC(=O)NC/C=C/c1ccccc1 273464a_100020603302_100020586998 [0,0,0,0,0,2|2,0,0]=4 11475 B16R1.1465 C=CCNC(=O)NC/C=C/c1ccccc1 512a_100020586998_100020603302 [0,0,0,0,0,2|2,0,0]=4 11476 B16R1.1465 C=CCNC(=O)NC/C=C/c1ccccc1 512a_100020603302_100020586998 [0,0,0,0,0,2|2,0,0]=4 11477 B16R1.1465 C=CCNC(=O)NCC#Cc1ccccc1 2708a_100000735379_100020586998 [0,0,0,0,0,2|2,0,0]=4 11478 B16R1.1465 C=CCNC(=O)NCC#Cc1ccccc1 273464a_100000735379_100020586998 [0,0,0,0,0,2|2,0,0]=4 11479 B16R1.1465 C=CCNC(=O)NCC#Cc1ccccc1 273464a_100020586998_100000735379 [0,0,0,0,0,2|2,0,0]=4 11480 B16R1.1465 C=CCNC(=O)NCC#Cc1ccccc1 512a_100000735379_100020586998 [0,0,0,0,0,2|2,0,0]=4 11481 B16R1.1465 C=CCNC(=O)NCC#Cc1ccccc1 512a_100020586998_100000735379 [0,0,0,0,0,2|2,0,0]=4 11482 B16R1.1465 C=CCNC(=O)NCCCc1ccccc1 2708a_100000211184_100020586998 [0,0,0,0,0,2|2,0,0]=4 11483 B16R1.1465 C=CCNC(=O)NCCCc1ccccc1 273464a_100000211184_100020586998 [0,0,0,0,0,2|2,0,0]=4 11484 B16R1.1465 C=CCNC(=O)NCCCc1ccccc1 273464a_100020586998_100000211184 [0,0,0,0,0,2|2,0,0]=4 11485 B16R1.1465 C=CCNC(=O)NCCCc1ccccc1 512a_100000211184_100020586998 [0,0,0,0,0,2|2,0,0]=4 11486 B16R1.1465 C=CCNC(=O)NCCCc1ccccc1 512a_100020586998_100000211184 [0,0,0,0,0,2|2,0,0]=4 11487 B16R1.1465 C=CCNC(=O)NCCOc1ccccc1 2708a_100000174943_100020586998 [0,0,0,0,0,2|1,0,0]=3 11488 B16R1.1465 C=CCNC(=O)NCCOc1ccccc1 273464a_100000174943_100020586998 [0,0,0,0,0,2|1,0,0]=3 11489 B16R1.1465 C=CCNC(=O)NCCOc1ccccc1 273464a_100020586998_100000174943 [0,0,0,0,0,2|1,0,0]=3 11490 B16R1.1465 C=CCNC(=O)NCCOc1ccccc1 512a_100000174943_100020586998 [0,0,0,0,0,2|1,0,0]=3 11491 B16R1.1465 C=CCNC(=O)NCCOc1ccccc1 512a_100020586998_100000174943 [0,0,0,0,0,2|1,0,0]=3 11492 B16R1.1465 C=CCNC(=O)NCCOc1ccccn1 2708a_106741647558_100020586998 [0,0,0,0,0,2|2,0,0]=4 11493 B16R1.1465 C=CCNC(=O)NCCOc1ccccn1 273464a_100020586998_106741647558 [0,0,0,0,0,2|2,0,0]=4 11494 B16R1.1465 C=CCNC(=O)NCCOc1ccccn1 273464a_106741647558_100020586998 [0,0,0,0,0,2|2,0,0]=4 11495 B16R1.1465 C=CCNC(=O)NCCOc1ccccn1 512a_100020586998_106741647558 [0,0,0,0,0,2|2,0,0]=4 11496 B16R1.1465 C=CCNC(=O)NCCOc1ccccn1 512a_106741647558_100020586998 [0,0,0,0,0,2|2,0,0]=4 11497 B16R1.1465 C=CCNC(=O)NCCOc1cccnc1 2708a_100000754688_100020586998 [0,0,0,0,0,2|2,0,0]=4 11498 B16R1.1465 C=CCNC(=O)NCCOc1cccnc1 273464a_100000754688_100020586998 [0,0,0,0,0,2|2,0,0]=4 11499 B16R1.1465 C=CCNC(=O)NCCOc1cccnc1 273464a_100020586998_100000754688 [0,0,0,0,0,2|2,0,0]=4 11500 B16R1.1465 C=CCNC(=O)NCCOc1cccnc1 512a_100000754688_100020586998 [0,0,0,0,0,2|2,0,0]=4 11501 B16R1.1465 C=CCNC(=O)NCCOc1cccnc1 512a_100020586998_100000754688 [0,0,0,0,0,2|2,0,0]=4 11502 B16R1.1465 C=CCNC(=O)NCCOc1ccncc1 2708a_100025717301_100020586998 [0,0,0,0,0,2|2,0,0]=4 11503 B16R1.1465 C=CCNC(=O)NCCOc1ccncc1 273464a_100020586998_100025717301 [0,0,0,0,0,2|2,0,0]=4 11504 B16R1.1465 C=CCNC(=O)NCCOc1ccncc1 273464a_100025717301_100020586998 [0,0,0,0,0,2|2,0,0]=4 11505 B16R1.1465 C=CCNC(=O)NCCOc1ccncc1 512a_100020586998_100025717301 [0,0,0,0,0,2|2,0,0]=4 11506 B16R1.1465 C=CCNC(=O)NCCOc1ccncc1 512a_100025717301_100020586998 [0,0,0,0,0,2|2,0,0]=4 11507 B16R1.1465 C=CCNC(=O)NCCSc1ccccc1 2708a_100000189519_100020586998 [0,0,0,0,0,2|1,1,0]=4 11508 B16R1.1465 C=CCNC(=O)NCCSc1ccccc1 273464a_100000189519_100020586998 [0,0,0,0,0,2|1,1,0]=4 11509 B16R1.1465 C=CCNC(=O)NCCSc1ccccc1 273464a_100020586998_100000189519 [0,0,0,0,0,2|1,1,0]=4 11510 B16R1.1465 C=CCNC(=O)NCCSc1ccccc1 512a_100000189519_100020586998 [0,0,0,0,0,2|1,1,0]=4 11511 B16R1.1465 C=CCNC(=O)NCCSc1ccccc1 512a_100020586998_100000189519 [0,0,0,0,0,2|1,1,0]=4 11512 B16R1.1465 C=CCNC(=O)NNCCc1ccccc1 273464a_100020586998_100000740470 [0,0,0,0,0,2|2,0,0]=4 11513 B16R1.1465 C=CCNC(=O)NNCCc1ccccc1 512a_100000740470_100020586998 [0,0,0,0,0,2|2,0,0]=4 11514 B16R1.1465 C=CCNC(=O)NNCCc1ccccc1 512a_100020586998_100000740470 [0,0,0,0,0,2|2,0,0]=4 11515 B16R1.1465 C=CCOC(=O)CNCCc1ccccc1 2230a_100000106460_100000033060 [0,0,0,0,0,2|1,0,0]=3 11516 B16R1.1465 C=CCOC(=O)CNCCc1ccccc1 34a_100000106460_100000033060 [0,0,0,0,0,2|1,0,0]=3 11517 B16R1.1465 C=CCOC(=O)CNCCc1cccnc1 2230a_100000736294_100000033060 [0,0,0,0,0,2|2,0,0]=4 11518 B16R1.1465 C=CCOC(=O)COCCc1ccccc1 34a_100000210268_100000033060 [0,0,0,0,0,2|0,0,0]=2 11519 B16R1.1465 C=CCOC(=O)COCCc1ccccc1 7a_100000210268_100000033060 [0,0,0,0,0,2|0,0,0]=2 11520 B16R1.1465 C=CCOC(=O)COCCc1ccccn1 34a_100000210271_100000033060 [0,0,0,0,0,2|1,0,0]=3 11521 B16R1.1465 C=CCOC(=O)COCCc1cccnc1 34a_100011217484_100000033060 [0,0,0,0,0,2|1,0,0]=3 11522 B16R1.1465 C=CCOC(=O)COCCc1ccncc1 34a_100011216225_100000033060 [0,0,0,0,0,2|1,0,0]=3 11523 B16R1.1465 C=CCOC(=O)COCCc1cnccn1 34a_100011349526_100000033060 [0,0,0,0,0,2|2,0,0]=4 11524 B16R1.1465 C=CCOC(=O)COCCc1cncnc1 34a_100011709255_100000033060 [0,0,0,0,0,2|2,0,0]=4 11525 B16R1.1465 C=CCOC(=O)CSCCc1ccccc1 62a_100000033060_100011218657 [0,0,0,0,0,2|0,1,0]=3 11526 B16R1.1465 C=CCOC(=O)CSCCc1ccccc1 62a_100000765856_100000033060 [0,0,0,0,0,2|0,1,0]=3 11527 B16R1.1465 C=CCOC(=O)CSCCc1ccccn1 62a_100000033060_100015183660 [0,0,0,0,0,2|1,1,0]=4 11528 B16R1.1465 C=CCOC(=O)CSCCc1ccccn1 62a_100015183660_100000033060 [0,0,0,0,0,2|1,1,0]=4 11529 B16R1.1465 C=CCOC(=O)CSCCc1cccnc1 62a_100000033060_200011713674 [0,0,0,0,0,2|1,1,0]=4 11530 B16R1.1465 C=CCOC(=O)CSCCc1cccnc1 62a_200011713674_100000033060 [0,0,0,0,0,2|1,1,0]=4 11531 B16R1.1465 C=CCOC(=O)CSCCc1ccncc1 62a_100000033060_100000723409 [0,0,0,0,0,2|1,1,0]=4 11532 B16R1.1465 C=CCOC(=O)CSCCc1ccncc1 62a_100000723409_100000033060 [0,0,0,0,0,2|1,1,0]=4 11533 B16R1.1465 C=CCOC(=O)CSCSc1ccccc1 62a_100000033060_100011218342 [0,0,0,0,0,2|0,1,0]=3 11534 B16R1.1465 C=CCOC(=O)CSCSc1ccccc1 62a_100011218342_100000033060 [0,0,0,0,0,2|0,1,0]=3 11535 B16R1.1465 CCCOC(=O)COCCc1ccccc1 34a_100000210268_200011215008 [0,0,0,0,0,2|0,0,2]=4 11536 B16R1.1465 CCCOC(=O)COCCc1ccccc1 7a_100000210268_200011215008 [0,0,0,0,0,2|0,0,2]=4 11537 B16R1.1465 CCCOC(=O)OCOCc1ccccc1 34a_100000210790_200000139673 [0,0,0,0,0,2|0,0,2]=4 11538 B16R1.1465 CCCOC(=O)OCOCc1ccccc1 7a_100000210790_200000139673 [0,0,0,0,0,2|0,0,2]=4