0 B10R1.59 c1c(c(sc1Br)Cl)C(=O)O CM10463 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.35 Cn1ccc(c1)C(=O)O CM10465 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.225 Cc1cc(c([nH]1)C)C(=O)OC CM10708 [0,1,0,0,0,0|1,0,0]=2 3 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br CM11177 [0,0,0,0,0,1|3,0,0]=4 4 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl CM11182 [0,0,0,0,0,1|3,0,0]=4 5 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F CM11162 [0,0,0,0,0,1|3,0,0]=4 6 B11R1.74 CC(=O)c1cc(cc(c1)F)F CM11190 [0,0,0,0,0,1|3,0,0]=4 7 B11R1.74 Cc1cc(cc(c1)C(=O)O)C CM12703 [0,0,0,0,0,1|2,0,0]=3 8 B11R1.74 Cc1cc(cc(c1)N)C(=O)O CM12429 [0,0,0,0,0,1|3,0,0]=4 9 B11R1.74 Cc1cc(cc(c1)[N+](=O)[O-])C CM12257 [0,0,0,0,0,1|3,0,0]=4 10 B11R1.166 CC(=O)c1c[nH]c(=O)[nH]c1=O CM14300 [0,0,0,0,0,1|3,0,0]=4 11 B11R1.166 CC(=O)c1ccc(cc1Br)N CM11122 [0,0,0,0,0,1|3,0,0]=4 12 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl CM11180 [0,0,0,0,0,1|3,0,0]=4 13 B11R1.166 CC(=O)c1ccc(cc1Cl)F CM11158 [0,0,0,0,0,1|3,0,0]=4 14 B11R1.166 CC(=O)c1ccc(cc1Cl)O CM11165 [0,0,0,0,0,1|3,0,0]=4 15 B11R1.166 CC(=O)c1ccc(cc1F)Br CM11145 [0,0,0,0,0,1|3,0,0]=4 16 B11R1.166 CC(=O)c1ccc(cc1F)Cl CM11163 [0,0,0,0,0,1|3,0,0]=4 17 B11R1.166 CC(=O)c1ccc(cc1N)F CM10552 [0,0,0,0,0,1|3,0,0]=4 18 B11R1.166 CC(=O)c1ccc(cc1O)Br CM14016 [0,0,0,0,0,1|3,0,0]=4 19 B11R1.166 CC(=O)c1ccc(cc1O)Cl CM14015 [0,0,0,0,0,1|3,0,0]=4 20 B11R1.166 CC(=O)c1ccc(cc1O)F CM14014 [0,0,0,0,0,1|3,0,0]=4 21 B11R1.166 CC(=O)c1ccc(cc1O)N CM11128 [0,0,0,0,0,1|3,0,0]=4 22 B11R1.166 Cc1cc(ccc1C(=O)O)F CM12767 [0,0,0,0,0,1|3,0,0]=4 23 B11R1.166 Cc1ccc(c(c1)C)C(=O)O CM10965 [0,0,0,0,0,1|2,0,0]=3 24 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O CM12591 [0,0,0,0,0,1|3,0,0]=4 25 B11R1.166 Cc1ccc(c(c1)F)C(=O)O CM10021 [0,0,0,0,0,1|3,0,0]=4 26 B11R1.166 Cc1ccc(c(c1)N)C(=O)O CM12428 [0,0,0,0,0,1|3,0,0]=4 27 B11R1.166 Cc1ccc(c(n1)C)[N+](=O)[O-] CM14042 [0,0,0,0,0,1|3,0,0]=4 28 B11R1.167 CC(=O)c1cc(ccc1Br)F CM10079 [0,0,0,0,0,1|3,0,0]=4 29 B11R1.167 CC(=O)c1cc(ccc1Cl)F CM11159 [0,0,0,0,0,1|3,0,0]=4 30 B11R1.167 CC(=O)c1cc(ccc1F)Br CM11147 [0,0,0,0,0,1|3,0,0]=4 31 B11R1.167 CC(=O)c1cc(ccc1I)F CM11201 [0,0,0,0,0,1|3,0,0]=4 32 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [0,0,0,0,0,1|3,0,0]=4 33 B11R1.167 Cc1ccc(c(c1)C(=O)N)N CM13166 [0,0,0,0,0,1|3,0,0]=4 34 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br CM12531 [0,0,0,0,0,1|3,0,0]=4 35 B11R1.167 Cc1ccc(c(c1)C(=O)O)C CM12701 [0,0,0,0,0,1|2,0,0]=3 36 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl CM12592 [0,0,0,0,0,1|3,0,0]=4 37 B11R1.167 Cc1ccc(c(c1)C(=O)O)F CM12761 [0,0,0,0,0,1|3,0,0]=4 38 B11R1.167 Cc1ccc(c(c1)C(=O)O)I CM12821 [0,0,0,0,0,1|3,0,0]=4 39 B11R1.167 Cc1ccc(cc1C(=O)O)Br CM12537 [0,0,0,0,0,1|3,0,0]=4 40 B11R1.167 Cc1ccc(cc1C(=O)O)F CM10930 [0,0,0,0,0,1|3,0,0]=4 41 B11R1.167 Cc1ccc(cc1C(=O)O)I CM12825 [0,0,0,0,0,1|3,0,0]=4 42 B11R1.167 Cc1ccc(cc1C(=O)O)N CM12431 [0,0,0,0,0,1|3,0,0]=4 43 B11R1.167 Cc1ccc(cc1C(=O)O)O CM10889 [0,0,0,0,0,1|3,0,0]=4 44 B8R1.11 c1csc(c1C=O)Br CM10421 [2,0,0,0,0,0|1,1,0]=4 45 B10R1.14 COC(=O)c1cc(sc1)Br CM10537 [1,1,0,0,0,0|1,1,0]=4 46 B12R1.358 Cc1cc(cc(n1)Cl)C(=O)OC CM11010 [0,1,0,0,0,1|2,0,0]=4 47 B12R1.511 Cc1cc(c(c(c1)C(=O)O)N)C CM12385 [0,1,0,0,0,1|2,0,0]=4 48 B12R1.1005 Cc1cc(cc(c1Br)C)C(=O)O CM12485 [0,1,0,0,0,1|2,0,0]=4 49 B12R1.1005 Cc1cc(cc(c1N)C)C(=O)O CM12390 [0,1,0,0,0,1|2,0,0]=4 50 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C CM10198 [0,1,0,0,0,1|2,0,0]=4 51 B12R1.452 CC(=O)c1ccc(cc1F)OC CM11202 [0,1,0,0,0,1|2,0,0]=4 52 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C CM10102 [0,1,0,0,0,1|2,0,0]=4 53 B12R1.354 Cc1ccc(cc1C(=O)OC)Br CM12536 [0,1,0,0,0,1|2,0,0]=4 54 B12R1.354 Cc1ccc(cc1C(=O)OC)F CM12768 [0,1,0,0,0,1|2,0,0]=4 55 B12R1.354 Cc1ccc(cc1C(=O)OC)I CM12826 [0,1,0,0,0,1|2,0,0]=4 56 B12R1.354 Cc1ccc(cc1C(=O)OC)O CM12807 [0,1,0,0,0,1|2,0,0]=4 57 B12R1.453 Cc1ccc(cc1C(=O)O)OC CM12834 [0,1,0,0,0,1|2,0,0]=4 58 B12R1.313 CCOC(=O)c1cc([nH]c1C)C CM10711 [0,2,0,0,0,0|1,0,0]=3 59 B12R1.3443 Cc1c([nH]c(c1C(=O)OC)C)C CM10709 [0,2,0,0,0,0|1,0,0]=3 60 B12R1.3443 Cc1c(c(c([nH]1)C)Br)C(=O)OC CM10707 [0,2,0,0,0,0|1,0,0]=3 61 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [0,0,1,1,0,0|1,0,1]=4 62 B12R2.612 c1cc2c(cc1Br)CCC2=O CM14359 [0,0,0,1,0,1|2,0,0]=4 63 B12R2.612 c1cc2c(cc1F)CCC2=O CM14361 [0,0,0,1,0,1|2,0,0]=4 64 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 CM14374 [0,0,0,1,0,1|2,0,0]=4 65 B10R1.8 Cc1cc(cc(c1)Cl)C=O CM11896 [1,0,0,0,0,1|2,0,0]=4 66 B10R1.8 Cc1cc(cc(c1)F)C=O CM11973 [1,0,0,0,0,1|2,0,0]=4 67 B10R1.8 Cc1cc(cc(c1)O)C=O CM10898 [1,0,0,0,0,1|2,0,0]=4 68 B10R1.8 Cc1cc(cc(c1)OC)C CM11742 [1,0,0,0,0,1|2,0,0]=4 69 B10R1.25 Cc1cc(ccc1C=O)F CM11974 [1,0,0,0,0,1|2,0,0]=4 70 B10R1.25 Cc1cc(ccc1C=O)O CM11992 [1,0,0,0,0,1|2,0,0]=4 71 B10R1.25 Cc1ccc(c(c1)F)C=O CM11969 [1,0,0,0,0,1|2,0,0]=4 72 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,0,0,0,0,1|2,0,0]=4 73 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,0,0,0,0,1|2,0,0]=4 74 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,0,0,0,0,1|2,0,0]=4 75 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [1,0,0,0,0,1|2,0,0]=4 76 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,0,0,0,0,1|1,0,0]=3 77 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,0,0,0,0,1|2,0,0]=4 78 B12R1.101 Cc1cc(cc(c1)CC(=O)O)C CM13698 [0,0,0,0,0,2|2,0,0]=4