0 B13R1.3 CCc1ccc(cc1)C=CC(=O)O AS01251 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.3 COc1ccc(cc1)C=CC(=O)O AS01561 [0,0,0,0,0,0|1,0,2]=3 2 B13R1.3 COc1ccc(cc1)CCC(=O)O AS04665 [0,0,0,0,0,0|1,0,0]=1 3 B13R1.3 c1cc(ccc1CCC(=O)O)C=O AS06508 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.21 c1cc(ccc1C=CC(=O)O)O AS03322 [1,0,0,0,0,0|1,0,2]=4 5 B12R1.21 c1cc(ccc1CCC(=O)O)F AS04666 [1,0,0,0,0,0|2,0,0]=3 6 B12R1.21 c1cc(ccc1CCC(=O)O)O AS02950 [1,0,0,0,0,0|1,0,0]=2 7 B14R1.2 COc1ccc(cc1)C(CC(=O)O)N AS06756 [0,1,0,0,0,0|1,0,0]=2 8 B14R1.103 COc1ccc(c(c1)F)C=CC(=O)O AS02613 [0,1,0,0,0,0|1,0,2]=4 9 B12R1.4 CC(=O)Nc1ccc(cc1)OC AS00987 [0,0,0,0,1,0|1,0,0]=2 10 B12R1.4 CC(=O)Oc1ccc(cc1)C=O AS03005 [0,0,0,0,1,0|3,0,0]=4 11 B12R1.4 CCc1ccc(cc1)CC(=O)C AS05185 [0,0,0,0,1,0|1,0,0]=2 12 B12R1.4 c1cc(ccc1CC(=O)O)C#N AS06094 [0,0,0,0,1,0|3,0,0]=4 13 B12R1.4 c1cc(ccc1CC(=O)O)CBr AS00533 [0,0,0,0,1,0|3,0,0]=4 14 B14R1.4 COc1ccc(cc1)CCCC(=O)N AS07224 [0,0,0,0,0,1|1,0,0]=2 15 B11R1.1 CCCCc1ccc(cc1)Cl AS02834 [2,0,0,0,0,0|1,0,1]=4 16 B11R1.1 CCCCc1ccc(cc1)I AS02288 [2,0,0,0,0,0|1,0,1]=4 17 B11R1.1 CCCCc1ccc(cc1)I AS02333 [2,0,0,0,0,0|1,0,1]=4 18 B11R1.1 COCCc1ccc(cc1)O AS00207 [2,0,0,0,0,0|1,0,0]=3 19 B11R1.91 CC(=O)COc1ccccc1 AS05273 [2,0,0,0,0,0|1,0,0]=3 20 B11R1.91 CC(=O)OCc1ccccc1 AS01460 [2,0,0,0,0,0|1,0,0]=3 21 B11R1.83 COc1ccc(cc1)CC#N AS01654 [2,0,0,0,0,0|1,0,1]=4 22 B11R1.83 COc1ccc(cc1)CC=O AS04419 [2,0,0,0,0,0|0,0,0]=2 23 B13R1.14 COC(=O)CCc1ccc(cc1)O AS06130 [1,1,0,0,0,0|0,0,0]=2 24 B13R1.132 Cc1ccc(cc1)[C@@H](CC(=O)O)N AS06755 [1,1,0,0,0,0|1,0,0]=3 25 B13R1.132 Cc1ccc(cc1)[C@H](CC(=O)O)N AS06754 [1,1,0,0,0,0|1,0,0]=3 26 B13R1.132 c1cc(ccc1[C@@H](CC(=O)O)N)Br AS06709 [1,1,0,0,0,0|2,0,0]=4 27 B13R1.132 c1cc(ccc1[C@@H](CC(=O)O)N)Cl AS06721 [1,1,0,0,0,0|2,0,0]=4 28 B13R1.132 c1cc(ccc1[C@@H](CC(=O)O)N)F AS06744 [1,1,0,0,0,0|2,0,0]=4 29 B13R1.132 c1cc(ccc1[C@H](CC(=O)O)N)Cl AS06720 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.133 C[C@H](C(=O)O)Oc1ccc(cc1)O AS04609 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.133 c1cc(ccc1CC(C(=O)O)N)N AS07029 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)Br AS06706 [1,1,0,0,0,0|2,0,0]=4 33 B13R1.371 COc1ccc(cc1)CCCCN AS07227 [1,1,0,0,0,0|0,0,1]=3 34 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)OC AS07057 [0,1,0,0,1,0|1,0,0]=3 35 B13R1.35 COc1ccc(cc1Br)CC(=O)O AS00515 [0,1,0,0,1,0|1,0,0]=3 36 B13R1.35 COc1ccc(cc1F)CC(=O)O AS02174 [0,1,0,0,1,0|1,0,0]=3 37 B13R1.35 COc1ccc(cc1O)CC(=O)O AS00514 [0,1,0,0,1,0|1,0,0]=3 38 B13R1.142 CCCc1ccc(cc1)CC(=O)O AS02187 [0,1,0,0,1,0|2,0,0]=4 39 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] AS05245 [0,1,0,0,1,0|2,0,0]=4 40 B13R1.653 CC(=O)Oc1ccc(cc1Br)OC AS02338 [0,1,0,0,1,0|1,0,0]=3 41 B13R1.653 CC(=O)Oc1ccc(cc1Br)OC AS04241 [0,1,0,0,1,0|1,0,0]=3 42 B13R1.653 CCc1ccc(c(c1)Br)NC(=O)C AS03247 [0,1,0,0,1,0|2,0,0]=4 43 B13R1.653 COc1ccc(c(c1)Br)CC(=O)O AS06082 [0,1,0,0,1,0|1,0,0]=3 44 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)O AS06088 [0,1,0,0,1,0|1,0,0]=3 45 B13R1.653 COc1ccc(c(c1)F)CC(=O)O AS01972 [0,1,0,0,1,0|1,0,0]=3 46 B15R1.3776 COc1ccc(cc1O)C(CC(=O)O)N AS06750 [0,2,0,0,0,0|1,0,0]=3 47 B15R1.3776 COc1ccc(cc1O)[C@@H](CC(=O)O)N AS06751 [0,2,0,0,0,0|1,0,0]=3 48 B15R1.793 CCOC(=O)CCc1ccc(cc1)C=O AS06509 [0,2,0,0,0,0|2,0,0]=4 49 B15R1.793 CCOC(=O)CCc1ccc(cc1)CO AS06897 [0,2,0,0,0,0|2,0,0]=4 50 B13R2.155 c1cc2c(cc1O)NC(=O)CO2 AS06389 [1,0,0,1,0,0|2,0,0]=4 51 B13R2.2121 Cc1cc2cc(ccc2[nH]1)OC AS06058 [0,0,0,1,1,0|2,0,0]=4 52 B11R1.20 CC(=O)Cc1ccc(cc1)F AS05241 [1,0,0,0,1,0|1,0,0]=3 53 B11R1.20 CC(=O)Nc1ccc(cc1)Br AS00912 [1,0,0,0,1,0|2,0,0]=4 54 B11R1.20 CC(=O)Nc1ccc(cc1)Cl AS02675 [1,0,0,0,1,0|2,0,0]=4 55 B11R1.20 CC(=O)Nc1ccc(cc1)F AS00825 [1,0,0,0,1,0|2,0,0]=4 56 B11R1.20 CC(=O)Nc1ccc(cc1)I AS02201 [1,0,0,0,1,0|2,0,0]=4 57 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AS07036 [1,0,0,0,1,0|2,0,0]=4 58 B11R1.20 CC(=O)Oc1ccc(cc1)F AS02347 [1,0,0,0,1,0|2,0,0]=4 59 B11R1.20 Cc1ccc(cc1)NC(=O)C AS00879 [1,0,0,0,1,0|1,0,0]=3 60 B11R1.20 c1cc(ccc1CC(=O)O)Br AS00507 [1,0,0,0,1,0|2,0,0]=4 61 B11R1.20 c1cc(ccc1CC(=O)O)Cl AS05024 [1,0,0,0,1,0|2,0,0]=4 62 B11R1.20 c1cc(ccc1CC(=O)O)F AS00530 [1,0,0,0,1,0|2,0,0]=4 63 B11R1.20 c1cc(ccc1CC(=O)O)I AS00544 [1,0,0,0,1,0|2,0,0]=4 64 B11R1.3 CC(=O)c1ccc(cc1)C#N AS05151 [0,0,0,0,2,0|2,0,0]=4 65 B11R1.3 CC(C)c1ccc(cc1)OC AS01008 [0,0,0,0,2,0|1,0,1]=4 66 B11R1.3 CC(c1ccc(cc1)OC)N AS04622 [0,0,0,0,2,0|1,0,1]=4 67 B11R1.3 CCc1ccc(cc1)C(=O)C AS03877 [0,0,0,0,2,0|1,0,0]=3 68 B11R1.3 CN(C)c1ccc(cc1)OC AS04610 [0,0,0,0,2,0|2,0,0]=4 69 B11R1.3 COc1ccc(cc1)C(=O)Cl AS00015 [0,0,0,0,2,0|1,0,0]=3 70 B11R1.3 COc1ccc(cc1)C(=O)O AS00727 [0,0,0,0,2,0|1,0,0]=3 71 B11R1.3 COc1ccc(cc1)C(=O)O AS03913 [0,0,0,0,2,0|1,0,0]=3 72 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] AS01804 [0,0,0,0,2,0|2,0,0]=4 73 B11R1.3 COc1ccc(cn1)C(=O)O AS01298 [0,0,0,0,2,0|2,0,0]=4 74 B11R1.3 C[C@H](c1ccc(cc1)OC)N AS04502 [0,0,0,0,2,0|1,0,1]=4