0 B12R1.4 CCc1ccc(cc1)CC(=O)C CM11252 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.4 c1cc(ccc1CC(=O)O)C#N CM13684 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.20 CC(=O)Cc1ccc(cc1)Cl CM10951 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.20 CC(=O)Cc1ccc(cc1)F CM10927 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.20 CC(=O)Oc1ccc(cc1)F CM12027 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.20 CC(C)Cc1ccc(cc1)Br CM12109 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.20 c1cc(ccc1CC(=O)O)F CM13704 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.20 c1cc(ccc1F)[ClH]C(=O)[O-] CM13921 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.20 c1cc(ccc1[ClH]C(=O)[O-])Br CM13923 [1,0,0,0,0,0|3,0,0]=4 9 B13R1.35 COc1ccc(cc1Br)CC(=O)O CM13661 [0,1,0,0,0,0|1,0,0]=2 10 B13R1.35 COc1ccc(cc1F)CC(=O)O CM13709 [0,1,0,0,0,0|1,0,0]=2 11 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] CM11257 [0,1,0,0,0,0|2,0,0]=3 12 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)C CM11221 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.653 COc1ccc(c(c1)Br)CC(=O)O CM13659 [0,1,0,0,0,0|1,0,0]=2 14 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)O CM13677 [0,1,0,0,0,0|1,0,0]=2 15 B13R1.653 COc1ccc(c(c1)F)CC(=O)O CM13707 [0,1,0,0,0,0|1,0,0]=2 16 B13R2.2121 Cc1cc2cc(ccc2[nH]1)OC CM13615 [0,0,0,1,0,0|2,0,0]=3 17 B11R1.3 CCc1ccc(nc1)C(=O)O CM10503 [0,0,0,0,1,0|3,0,0]=4 18 B11R1.3 CN(C)c1ccc(cc1)OC CM11444 [0,0,0,0,1,0|2,0,0]=3 19 B11R1.3 c1cc(ccc1CBr)C(=O)O CM10952 [0,0,0,0,1,0|3,0,0]=4 20 B13R1.3 c1cc(ccc1CCC(=O)O)C=O CM10124 [0,0,0,0,0,1|3,0,0]=4 21 B10R1.1 Cc1ccc(cc1)CC#N CM13728 [2,0,0,0,0,0|1,0,1]=4 22 B10R1.1 c1cc(ccc1CCO)O CM10966 [2,0,0,0,0,0|0,0,2]=4 23 B10R1.3 CSc1ccc(cc1)CN CM13545 [2,0,0,0,0,0|1,1,0]=4 24 B12R1.19 Cc1ccc(cc1C)CC(=O)O CM13697 [1,1,0,0,0,0|1,0,0]=3 25 B12R1.19 c1cc(c(cc1CC(=O)O)Br)O CM13658 [1,1,0,0,0,0|1,0,0]=3 26 B12R1.19 c1cc(c(cc1CC(=O)O)F)Cl CM13673 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.19 c1cc(c(cc1CC(=O)O)F)O CM13706 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.49 COC(=O)Cc1ccc(cc1)O CM13716 [1,1,0,0,0,0|0,0,0]=2 29 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O CM13655 [1,1,0,0,0,0|2,0,0]=4 30 B12R1.233 c1cc(c(cc1Cl)F)CC(=O)O CM13670 [1,1,0,0,0,0|2,0,0]=4 31 B12R1.233 c1cc(c(cc1F)F)CC(=O)O CM13690 [1,1,0,0,0,0|2,0,0]=4 32 B12R1.233 c1cc(c(cc1N)F)CC(=O)O CM13648 [1,1,0,0,0,0|2,0,0]=4 33 B12R1.116 CCOc1ccc(cc1)CC#N CM13699 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.48 CC(=O)c1ccc(c(c1)Br)C#N CM12901 [0,1,0,0,1,0|2,0,0]=4 35 B12R1.48 CC(=O)c1ccc(c(c1)F)OC CM11203 [0,1,0,0,1,0|0,0,0]=2 36 B12R1.48 COc1ccc(cc1F)C(=O)Cl CM12751 [0,1,0,0,1,0|1,0,0]=3 37 B12R1.48 COc1ccc(cc1F)C(=O)O CM12750 [0,1,0,0,1,0|1,0,0]=3 38 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] CM11783 [0,1,0,0,1,0|2,0,0]=4 39 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] CM11600 [0,1,0,0,1,0|2,0,0]=4 40 B12R1.48 Cc1cc(ccc1C#N)C(=O)C CM11174 [0,1,0,0,1,0|2,0,0]=4 41 B12R1.48 Cc1cc(ccc1OC)[N+](=O)[O-] CM11789 [0,1,0,0,1,0|2,0,0]=4 42 B12R1.256 CC(=O)c1ccc(cc1)C(=O)O CM12342 [0,1,0,0,1,0|2,0,0]=4 43 B12R1.452 CC(=O)c1ccc(cc1F)OC CM11202 [0,1,0,0,1,0|0,0,0]=2 44 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl CM12745 [0,1,0,0,1,0|1,0,0]=3 45 B12R1.452 COc1ccc(c(c1)F)C(=O)O CM12744 [0,1,0,0,1,0|1,0,0]=3 46 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] CM11769 [0,1,0,0,1,0|2,0,0]=4 47 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] CM11785 [0,1,0,0,1,0|2,0,0]=4 48 B12R1.452 COc1ccc(c(c1)N)C(=O)O CM12421 [0,1,0,0,1,0|1,0,0]=3 49 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] CM11786 [0,1,0,0,1,0|2,0,0]=4 50 B12R1.452 COc1ccc(c(n1)F)C(=O)O CM10677 [0,1,0,0,1,0|2,0,0]=4 51 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])OC CM11787 [0,1,0,0,1,0|2,0,0]=4 52 B14R1.717 COC(=O)c1ccc(cc1)OC(=O)Cl CM13922 [0,2,0,0,0,0|2,0,0]=4 53 B14R1.560 COc1cc(c(c(c1)F)CC(=O)O)F CM13695 [0,2,0,0,0,0|1,0,0]=3 54 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 CM14289 [1,0,0,1,0,0|2,0,0]=4 55 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 CM14364 [1,0,0,1,0,0|2,0,0]=4 56 B12R2.606 c1cc2c(cc1F)NC(=O)C2 CM14302 [1,0,0,1,0,0|2,0,0]=4 57 B14R2.1008 c1cc2c(cc1CC(=O)O)OCO2 CM13726 [0,1,0,1,0,0|1,0,0]=3 58 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,0,0,0,1,0|1,0,0]=3 59 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,0,0,0,1,0|1,0,0]=3 60 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,0,0,0,1,0|1,0,0]=3 61 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,0,0,0,1,0|1,0,0]=3 62 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [1,0,0,0,1,0|2,0,0]=4 63 B10R1.13 CN(C)c1ccc(cc1)O CM10392 [1,0,0,0,1,0|2,0,0]=4 64 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,0,0,0,1,0|0,0,0]=2 65 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,0,0,0,1,0|1,0,0]=3 66 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [1,0,0,0,1,0|2,0,0]=4 67 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [1,0,0,0,1,0|2,0,0]=4 68 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [1,0,0,0,1,0|2,0,0]=4 69 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [1,0,0,0,1,0|2,0,0]=4 70 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [1,0,0,0,1,0|2,0,0]=4 71 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [1,0,0,0,1,0|2,0,0]=4 72 B12R1.438 CC(=O)Cc1cccc(c1)OC CM11254 [0,0,0,0,1,1|0,0,0]=2 73 B14R1.4 COc1ccc(cc1)CCCC(=O)N CM14113 [0,0,0,0,0,2|1,0,0]=3 74 B14R1.4 COc1ccc(cc1)CCCC(=O)O CM14000 [0,0,0,0,0,2|1,0,0]=3