0 B11R1.3 COc1ccc(cc1)C(=C)C CSC011935109 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.3 COc1ccc(cc1)C(C)C CSC000174001 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.3 COc1ccc(cc1)[C@@H](C)O CSC000744170 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.3 CSc1ccc(cc1)C(C)C CSC000044649 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.3 NC(=O)c1ccc(cc1)C=C CSC000123571 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.3 COc1ccc(cc1)SC CSC000007070 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.3 CSc1ccc(cc1)C#N CSC000188601 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.13 CS(=O)c1ccc(cc1)Br CSC009816266 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.13 CS(=O)c1ccc(cc1)Cl CSC000064343 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.13 CS(=O)c1ccc(cc1)F CSC011920622 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 Cc1ccc(cc1)S(=O)C CSC000031592 [1,0,0,0,0,0|2,0,1]=4 12 B12R1.5 COC(=O)c1ccc(cc1)C=C CSC000061247 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.6 COc1ccc(cc1)C(C)(C)O CSC000744786 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.113 CCNc1ccc(cc1)C(C)C CSC000220648 [0,1,0,0,0,0|1,0,1]=3 15 B12R1.113 CCSc1ccc(cc1)C(C)C CSC000031259 [0,1,0,0,0,0|1,0,1]=3 16 B12R1.256 CC(C)c1ccc(cc1)C(=O)N CSC000162222 [0,1,0,0,0,0|0,0,0]=1 17 B12R1.256 NC(=O)c1ccc(cc1)C(=O)N CSC000175741 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.256 NC(=O)c1ccc(cc1)[N+](=O)[O-] CSC000162182 [0,1,0,0,0,0|3,0,0]=4 19 B12R1.4 CC(C)Nc1ccc(cc1)C#N CSC011200357 [0,0,0,0,0,1|1,0,1]=3 20 B12R1.4 CC(C)Nc1ccc(cn1)C#N CSC000738296 [0,0,0,0,0,1|2,0,1]=4 21 B12R1.4 CC(C)Oc1ccc(cc1)C#N CSC000170013 [0,0,0,0,0,1|1,0,1]=3 22 B12R1.4 COc1ccc(cc1)SC(C)C CSC000019069 [0,0,0,0,0,1|2,0,0]=3 23 B9R1.1 CNc1ccc(cc1)Br CSC000219623 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.1 CNc1ccc(cc1)Cl CSC000220157 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.1 COc1ccc(cc1)Br CSC000169945 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.1 COc1ccc(cc1)Cl CSC000169959 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.1 COc1ccc(cc1)I CSC000171711 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.1 CSc1ccc(cc1)Br CSC000149455 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.1 CSc1ccc(cc1)Cl CSC000150468 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.1 CSc1ccc(cc1)F CSC000000078 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.1 CSc1ccc(cc1)O CSC000211864 [2,0,0,0,0,0|1,0,1]=4 32 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.83 CCCc1ccc(cc1)OC CSC000034192 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.83 CCOc1ccc(cc1)CN CSC000185588 [1,1,0,0,0,0|1,0,1]=4 35 B11R1.83 CCOc1ccc(cc1)CO CSC000173027 [1,1,0,0,0,0|0,0,2]=4 36 B11R1.83 CCOc1ccc(cc1)SC CSC000021790 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.83 CCSc1ccc(cc1)OC CSC000021481 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.83 COCc1ccc(cc1)SC CSC010272925 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.83 COc1ccc(cc1)CCO CSC011219623 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.83 CSCc1ccc(cc1)SC CSC000051362 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.142 CNCc1ccc(cc1)OC(C)C CSC000713913 [0,1,0,0,0,1|1,0,1]=4 42 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C CSC000152756 [0,1,0,0,0,1|1,0,1]=4 43 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N CSC000154964 [0,1,0,0,0,1|1,0,1]=4 44 B13R1.585 CC(=O)Oc1ccc(cc1)C(=O)N CSC000002065 [0,1,0,0,0,1|1,0,1]=4 45 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] CSC000156089 [0,1,0,0,0,1|1,0,0]=3 46 B13R1.585 CC(C)Nc1ccc(cn1)[N+](=O)[O-] CSC011193206 [0,1,0,0,0,1|2,0,0]=4 47 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)N CSC000162262 [0,1,0,0,0,1|0,0,0]=2 48 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] CSC000005801 [0,1,0,0,0,1|1,0,0]=3 49 B13R1.585 CC(C)Sc1ccc(cn1)[N+](=O)[O-] CSC010369087 [0,1,0,0,0,1|2,0,0]=4 50 B13R1.452 CCNC(C)c1ccc(cc1)OC CSC000737452 [0,2,0,0,0,0|2,0,0]=4 51 B13R1.537 CC(C)c1ccc(cc1)C(=O)NN CSC000189789 [0,2,0,0,0,0|0,0,0]=2 52 B13R1.537 CN(C)c1ccc(cc1)C(=O)NN CSC000189820 [0,2,0,0,0,0|1,0,0]=3 53 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C CSC000033754 [0,2,0,0,0,0|1,0,1]=4 54 B13R1.537 COC(=O)c1ccc(cc1)C(C)C CSC000148701 [0,2,0,0,0,0|0,0,0]=2 55 B13R1.537 COC(=O)c1ccc(cc1)C(F)F CSC000059331 [0,2,0,0,0,0|2,0,0]=4 56 B13R1.537 COC(=O)c1ccc(cc1)N(C)C CSC000148938 [0,2,0,0,0,0|1,0,0]=3 57 B13R1.537 COC(=O)c1ccc(nc1)N(C)C CSC011258103 [0,2,0,0,0,0|2,0,0]=4 58 B13R1.140 CCOc1ccc(cc1)C(C)(C)C CSC000170206 [0,2,0,0,0,0|1,0,1]=4 59 B13R1.140 CCOc1ccc(cc1)C(C)(C)O CSC011753706 [0,2,0,0,0,0|1,0,1]=4 60 B13R1.338 CC(C)(C)c1ccc(cc1)C(=O)N CSC000162180 [0,2,0,0,0,0|0,0,0]=2 61 B13R1.338 CC(C)(C)c1ncc(cn1)C(=O)N CSC010782086 [0,2,0,0,0,0|2,0,0]=4 62 B11R1.20 CC(C)Nc1ccc(cc1)Br CSC000219625 [1,0,0,0,0,1|1,0,0]=3 63 B11R1.20 CC(C)Sc1ccc(cc1)Br CSC009811894 [1,0,0,0,0,1|1,0,0]=3 64 B11R1.20 CC(C)Sc1ccc(cc1)C CSC000006694 [1,0,0,0,0,1|0,0,1]=3 65 B11R1.20 CC(C)Sc1ccc(cc1)Cl CSC000005997 [1,0,0,0,0,1|1,0,0]=3 66 B11R1.20 CC(C)Sc1ccc(cc1)F CSC000006008 [1,0,0,0,0,1|1,0,0]=3 67 B13R1.3 CC(C)COc1ccc(cc1)C#N CSC000170015 [0,0,0,0,0,2|1,0,1]=4 68 B13R1.3 CC(C)COc1ccc(cc1)CN CSC000185590 [0,0,0,0,0,2|1,0,1]=4 69 B13R1.3 CCc1ccc(cc1)CNC(C)C CSC000195796 [0,0,0,0,0,2|1,0,1]=4 70 B13R1.3 COc1ccc(cc1)CNC(C)C CSC000195754 [0,0,0,0,0,2|2,0,0]=4 71 B13R1.3 CSc1ccc(cc1)CNC(C)C CSC000195780 [0,0,0,0,0,2|2,0,0]=4 72 B13R1.3 CSc1ccc(cc1)OCC(C)C CSC000018388 [0,0,0,0,0,2|2,0,0]=4