0 B12R1.77 COC(=O)c1ccccc1CBr CM12526 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.41 CCOc1ccccc1OC CM11747 [1,0,0,0,0,0|2,0,0]=3 2 B11R1.53 B(c1cccnc1OC)(O)O CM10017 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.53 CC(=O)c1cccnc1OC CM10529 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.53 COc1c(nccn1)C(=O)O CM10657 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.53 c1ccc(c(c1)C#N)C(=O)O CM12612 [1,0,0,0,0,0|2,0,0]=3 6 B13R1.89 CC(C)C(=O)c1ccccc1SC CM10043 [0,1,0,0,0,0|1,1,0]=3 7 B13R1.382 COC(=O)c1ccccc1CCN CM12391 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.2065 COC(=O)c1ccc(cc1CBr)Br CM12454 [0,1,0,0,0,0|2,0,0]=3 9 B13R1.2209 COC(=O)c1cc(ccc1C#N)Cl CM12560 [0,1,0,0,0,0|2,0,0]=3 10 B13R1.2209 COc1ccc(cc1C(=O)CBr)F CM11148 [0,1,0,0,0,0|2,0,0]=3 11 B13R1.2357 COc1cccc(c1C(=O)OC)F CM12747 [0,1,0,0,0,0|0,0,0]=1 12 B13R1.91 COC(=O)Cc1ccccc1C#N CM13681 [0,0,0,0,0,1|2,0,0]=3 13 B10R1.20 COc1ccccc1CCl CM13440 [2,0,0,0,0,0|1,0,1]=4 14 B10R1.20 COc1ccccc1NN CM13803 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.61 CC(=O)c1ccccc1Br CM11134 [2,0,0,0,0,0|1,0,0]=3 16 B10R1.61 CC(=O)c1ccccc1I CM11218 [2,0,0,0,0,0|1,0,0]=3 17 B10R1.61 c1ccc(c(c1)C(=O)N)I CM13180 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [2,0,0,0,0,0|1,0,0]=3 19 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.61 c1cncc(c1Br)C(=O)O CM14036 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.15 COC(=O)c1cccnc1 CM10959 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.46 COc1ccc(cc1C(=O)O)F CM10931 [1,1,0,0,0,0|0,0,0]=2 24 B12R1.46 c1cc(c(cc1Br)C(=O)O)C#N CM12472 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.57 COc1c(ccc(n1)F)C(=O)O CM10675 [1,1,0,0,0,0|1,0,0]=3 26 B12R1.57 COc1cc(ccc1C(=O)O)F CM12752 [1,1,0,0,0,0|0,0,0]=2 27 B12R1.57 COc1cc(ccc1C(=O)O)O CM10237 [1,1,0,0,0,0|0,0,0]=2 28 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br CM11664 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl CM11697 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F CM11774 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] CM11790 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.87 B(c1cccc(c1OC)F)(O)O CM13570 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.87 COc1c(cccc1Br)[N+](=O)[O-] CM11660 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.87 COc1c(cccc1Cl)[N+](=O)[O-] CM11694 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.87 COc1c(cccc1F)C(=O)O CM12749 [1,1,0,0,0,0|0,0,0]=2 36 B12R1.261 CC(C)c1ccccc1C(=O)O CM12827 [1,1,0,0,0,0|1,0,0]=3 37 B12R1.437 CC(=O)c1c(cccc1OC)O CM11215 [1,1,0,0,0,0|0,0,0]=2 38 B12R1.437 COc1cccc(c1C(=O)O)Br CM12522 [1,1,0,0,0,0|0,0,0]=2 39 B12R1.437 COc1cccc(c1C(=O)O)F CM10857 [1,1,0,0,0,0|0,0,0]=2 40 B12R1.437 COc1cccc(c1C(=O)O)N CM12424 [1,1,0,0,0,0|0,0,0]=2 41 B12R1.437 Cc1cccc(c1C(=O)N)OC CM13182 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.437 Cc1cccc(c1C(=O)O)OC CM12829 [1,1,0,0,0,0|0,0,0]=2 43 B12R1.24 COC(=O)c1cccc(c1F)Br CM12492 [1,1,0,0,0,0|1,0,0]=3 44 B12R1.24 COC(=O)c1cccc(c1F)N CM12401 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.24 COC(=O)c1cccc(c1N)Br CM12346 [1,1,0,0,0,0|1,0,0]=3 46 B12R1.24 COC(=O)c1cccc(c1N)Cl CM12357 [1,1,0,0,0,0|1,0,0]=3 47 B12R1.24 COC(=O)c1cccc(c1N)F CM12393 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.24 COC(=O)c1cccc(c1N)N CM12633 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.24 COC(=O)c1cccc(c1N)O CM12414 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.24 COC(=O)c1cccc(c1O)Br CM12511 [1,1,0,0,0,0|0,0,0]=2 51 B12R1.24 COC(=O)c1cccc(c1O)F CM12719 [1,1,0,0,0,0|0,0,0]=2 52 B12R1.24 Cc1c(cccc1Br)C(=O)OC CM12534 [1,1,0,0,0,0|0,0,0]=2 53 B12R1.24 Cc1c(cccc1N)C(=O)OC CM12427 [1,1,0,0,0,0|0,0,0]=2 54 B12R1.24 Cc1cccc(c1Br)C(=O)OC CM12529 [1,1,0,0,0,0|1,0,0]=3 55 B12R1.24 Cc1cccc(c1F)C(=O)OC CM12757 [1,1,0,0,0,0|1,0,0]=3 56 B12R1.354 COC(=O)c1cc(ccc1Br)F CM12489 [1,1,0,0,0,0|1,0,0]=3 57 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CM12466 [1,1,0,0,0,0|1,0,0]=3 58 B12R1.354 COC(=O)c1cc(ccc1F)Br CM12503 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.354 COC(=O)c1cc(ccc1F)I CM12734 [1,1,0,0,0,0|1,0,0]=3 60 B12R1.354 COC(=O)c1cc(ccc1I)Br CM12520 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.354 COC(=O)c1cc(ccc1N)Br CM12350 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.354 COC(=O)c1cc(ccc1N)F CM12397 [1,1,0,0,0,0|1,0,0]=3 63 B12R1.354 Cc1ccc(cc1C(=O)OC)Br CM12536 [1,1,0,0,0,0|0,0,0]=2 64 B12R1.354 Cc1ccc(cc1C(=O)OC)F CM12768 [1,1,0,0,0,0|0,0,0]=2 65 B12R1.354 Cc1ccc(cc1C(=O)OC)I CM12826 [1,1,0,0,0,0|0,0,0]=2 66 B12R1.354 Cc1ccc(cc1C(=O)OC)O CM12807 [1,1,0,0,0,0|0,0,0]=2 67 B12R1.1703 CCC(=O)c1ccc(cc1F)Br CM10141 [1,1,0,0,0,0|2,0,0]=4 68 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CM13187 [1,1,0,0,0,0|2,0,0]=4 69 B12R1.1703 CNC(=O)c1ccc(cc1F)I CM13186 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CM12459 [1,1,0,0,0,0|1,0,0]=3 71 B12R1.1703 COC(=O)c1ccc(cc1Br)F CM12487 [1,1,0,0,0,0|1,0,0]=3 72 B12R1.1703 COC(=O)c1ccc(cc1Cl)Br CM12464 [1,1,0,0,0,0|1,0,0]=3 73 B12R1.1703 COC(=O)c1ccc(cc1Cl)N CM12362 [1,1,0,0,0,0|1,0,0]=3 74 B12R1.1703 COC(=O)c1ccc(cc1F)Br CM12498 [1,1,0,0,0,0|1,0,0]=3 75 B12R1.1703 COC(=O)c1ccc(cc1F)F CM12656 [1,1,0,0,0,0|1,0,0]=3 76 B12R1.1703 COC(=O)c1ccc(cc1F)I CM12732 [1,1,0,0,0,0|1,0,0]=3 77 B12R1.1703 COC(=O)c1ccc(cc1F)N CM12404 [1,1,0,0,0,0|1,0,0]=3 78 B12R1.1703 COC(=O)c1ccc(cc1F)O CM12714 [1,1,0,0,0,0|1,0,0]=3 79 B12R1.1703 COC(=O)c1ccc(cc1N)Br CM12348 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.1703 COC(=O)c1ccc(cc1N)F CM12395 [1,1,0,0,0,0|1,0,0]=3 81 B12R1.1703 COC(=O)c1ccc(cc1O)F CM12722 [1,1,0,0,0,0|0,0,0]=2 82 B12R1.3441 COC(=O)c1c(cccc1Br)F CM12490 [1,1,0,0,0,0|1,0,0]=3 83 B12R1.3441 COC(=O)c1c(cccc1F)N CM12399 [1,1,0,0,0,0|1,0,0]=3 84 B12R1.3441 COC(=O)c1c(cccc1F)O CM12717 [1,1,0,0,0,0|0,0,0]=2 85 B12R1.3441 Cc1cccc(c1C(=O)OC)Br CM12532 [1,1,0,0,0,0|0,0,0]=2 86 B12R1.3441 Cc1cccc(c1C(=O)OC)F CM12762 [1,1,0,0,0,0|0,0,0]=2 87 B14R1.263 CCOC(=O)c1ccccc1CC#N CM12627 [0,2,0,0,0,0|1,0,1]=4 88 B14R1.5122 COC(=O)c1ccc(cc1CC#N)Br CM12471 [0,2,0,0,0,0|1,0,1]=4 89 B14R1.599 CCOC(=O)c1cc(ccc1C#N)F CM12618 [0,2,0,0,0,0|2,0,0]=4 90 B14R1.707 COC(=O)c1cc(ccc1[N+](=O)[O-])Br CM12542 [0,2,0,0,0,0|2,0,0]=4 91 B14R1.707 COC(=O)c1cc(ccc1[N+](=O)[O-])F CM12786 [0,2,0,0,0,0|2,0,0]=4 92 B14R1.2315 COc1ccc(cc1C(=O)OC)C#N CM12626 [0,2,0,0,0,0|0,0,0]=2 93 B14R1.2315 COc1ccc(cc1C(=O)OC)C=O CM14011 [0,2,0,0,0,0|0,0,0]=2