0 B10R1.15 CCC(C)c1ccccc1 CM12120 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.15 COC(=O)c1cccnc1 CM10959 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [0,0,0,0,0,0|1,0,2]=3 3 B10R1.15 c1ccc(cc1)C(C#N)N CM11081 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.6 B(c1ccncc1)(O)O CM10013 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.8 c1ccc(cc1)CNN CM14002 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.8 c1ccc(cc1)CNO CM10002 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.12 B(CC)(CC)c1cccnc1 CM10967 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.12 COC(c1ccncn1)OC CM10695 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.16 CCOC(=O)c1cccnc1 CM10029 [0,1,0,0,0,0|1,0,2]=4 10 B11R1.22 COC(=O)c1ccc(cc1)N CM12345 [0,1,0,0,0,0|1,0,2]=4 11 B11R1.22 c1cc(ccc1C(=O)CBr)Br CM11176 [0,1,0,0,0,0|1,0,2]=4 12 B11R1.22 c1cc(ccc1C(=O)CBr)Cl CM11135 [0,1,0,0,0,0|1,0,2]=4 13 B11R1.22 c1cc(ccc1C(=O)CBr)F CM11141 [0,1,0,0,0,0|1,0,2]=4 14 B11R1.22 c1cc(ccc1C(=O)CN)Br CM11121 [0,1,0,0,0,0|1,0,2]=4 15 B11R1.22 c1cc(ccc1C(CO)O)Br CM10185 [0,1,0,0,0,0|1,0,0]=2 16 B11R1.23 CCC(=O)c1cccc(c1)N CM11248 [0,1,0,0,0,0|0,0,2]=3 17 B11R1.23 COC(=O)c1cccc(c1)I CM12817 [0,1,0,0,0,0|1,0,2]=4 18 B11R1.23 COC(=O)c1cccc(c1)N CM12344 [0,1,0,0,0,0|1,0,2]=4 19 B11R1.23 COC(=O)c1cccc(c1)O CM12802 [0,1,0,0,0,0|1,0,2]=4 20 B11R1.23 c1cc(cc(c1)O)C(=O)CBr CM11149 [0,1,0,0,0,0|1,0,2]=4 21 B11R1.222 CCC(C)c1ccccc1N CM11342 [0,1,0,0,0,0|1,0,0]=2 22 B11R2.1 c1ccc2c(c1)CNC2=O CM10840 [0,0,0,1,0,0|1,0,2]=4 23 B11R2.1 c1ccc2c(c1)c(no2)O CM10137 [0,0,0,1,0,0|2,0,1]=4 24 B8R1.2 COc1cccnc1 CM10357 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.13 B(c1ccc(cc1)F)(O)O CM13569 [1,1,0,0,0,0|2,0,0]=4 26 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,1,0,0,0,0|1,0,1]=4 27 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,1,0,0,0,0|0,0,2]=4 28 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,1,0,0,0,0|0,0,2]=4 29 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,1,0,0,0,0|0,0,2]=4 30 B10R1.13 CC(c1ccc(cc1)Cl)N CM13559 [1,1,0,0,0,0|1,0,0]=3 31 B10R1.13 CN(C)c1ccc(cc1)Cl CM11355 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.13 CN(C)c1ccc(cc1)O CM10392 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,1,0,0,0,0|0,0,2]=4 34 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [1,1,0,0,0,0|1,0,1]=4 36 B10R1.13 c1cc(ccc1C(F)F)Br CM12065 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.61 CC(=O)c1ccccc1Br CM11134 [1,1,0,0,0,0|0,0,2]=4 38 B10R1.61 CC(=O)c1ccccc1I CM11218 [1,1,0,0,0,0|0,0,2]=4 39 B10R1.61 CC(C)c1ccccc1Br CM12111 [1,1,0,0,0,0|1,0,0]=3 40 B10R1.61 CN(C)c1ccccc1F CM11439 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [1,1,0,0,0,0|1,0,1]=4 43 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [1,1,0,0,0,0|0,0,2]=4 44 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [1,1,0,0,0,0|0,0,2]=4 45 B10R1.113 CC(C)c1cccc(c1)Br CM12107 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.113 CC(C)c1cccc(n1)Br CM13845 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.113 CC(c1cccc(c1)F)N CM13557 [1,1,0,0,0,0|1,0,0]=3 48 B10R1.113 CC(c1cccc(c1)F)O CM13506 [1,1,0,0,0,0|0,0,0]=2 49 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [1,1,0,0,0,0|0,0,2]=4 50 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.113 c1cc(cc(c1)F)C(=O)O CM12710 [1,1,0,0,0,0|1,0,1]=4 52 B10R1.113 c1cc(cc(c1)F)C(F)F CM12223 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.113 c1cc(cc(c1)S)C(=O)O CM10051 [1,1,0,0,0,0|1,0,1]=4 54 B10R1.1 Cc1ccc(cc1)CC#N CM13728 [1,1,0,0,0,0|1,0,1]=4 55 B10R1.1 c1cc(ccc1CC#N)F CM13705 [1,1,0,0,0,0|1,0,1]=4 56 B10R1.1 c1cc(ccc1CCBr)Cl CM13503 [1,1,0,0,0,0|1,0,0]=3 57 B10R1.1 c1cc(ccc1CCBr)F CM13509 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.1 c1cc(ccc1CCCl)Cl CM13502 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.1 c1cc(ccc1CCO)Cl CM13495 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.1 c1cc(ccc1CCO)F CM13508 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.1 c1cc(ccc1CCO)O CM10966 [1,1,0,0,0,0|1,0,0]=3 62 B10R1.4 CCOc1cnccc1N CM10330 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.4 c1ccc(c(c1)CC#N)N CM13645 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.4 c1ccc(c(c1)CCO)Br CM13494 [1,1,0,0,0,0|1,0,0]=3 65 B10R1.10 c1cc(cc(c1)Br)CC#N CM13649 [1,1,0,0,0,0|1,0,1]=4 66 B10R1.10 c1cc(cc(c1)F)CC#N CM13701 [1,1,0,0,0,0|1,0,1]=4 67 B10R1.10 c1cc(cc(c1)F)CCN CM13556 [1,1,0,0,0,0|1,0,0]=3 68 B10R1.10 c1cc(cc(c1)F)CCO CM13507 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.10 c1cc(cc(c1)N)CC#N CM13646 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.10 c1cc(cc(c1)N)CCO CM10010 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.10 c1cc(cc(c1)O)CNN CM14001 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.243 COC(c1ccccc1I)OC CM11997 [0,2,0,0,0,0|1,0,0]=3 73 B12R1.16 c1cc(ccc1C(=O)CCCl)Cl CM11249 [0,2,0,0,0,0|0,0,2]=4 74 B12R1.107 CC(c1ccccc1)NC(=O)C CM11017 [0,2,0,0,0,0|1,0,1]=4 75 B12R1.5 CCc1ccc(cc1)C(=O)CC CM11251 [0,2,0,0,0,0|0,0,2]=4 76 B12R1.1703 CCC(=O)c1ccc(cc1F)Br CM10141 [0,2,0,0,0,0|0,0,2]=4 77 B12R1.358 CCC(=O)c1cc(cc(c1)Cl)Cl CM11250 [0,2,0,0,0,0|0,0,2]=4 78 B12R1.564 c1ccc(cc1)C(C(F)(F)F)O CM13493 [0,2,0,0,0,0|1,0,0]=3 79 B10R2.7 c1ccc2c(c1)CNC2 CM10320 [1,0,0,1,0,0|1,0,0]=3 80 B12R2.24 c1ccc2c(c1)CCN(C2)N CM10279 [0,0,0,1,0,1|2,0,0]=4 81 B12R2.1081 c1cc2c(nc1)C(CCC2)N CM10574 [0,1,0,1,0,0|2,0,0]=4 82 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 CM10829 [0,1,0,1,0,0|0,0,2]=4 83 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 CM13881 [0,1,0,1,0,0|0,0,2]=4 84 B12R2.1081 c1ccc2c(c1)C(CCO2)N CM10306 [0,1,0,1,0,0|1,0,0]=3 85 B12R2.1081 c1ccc2c(c1)CCOC2=O CM10132 [0,1,0,1,0,0|0,0,2]=4 86 B12R2.612 c1cc2c(cc1Br)CCC2=O CM14359 [0,1,0,1,0,0|0,0,2]=4 87 B12R2.612 c1cc2c(cc1F)CCC2=O CM14361 [0,1,0,1,0,0|0,0,2]=4 88 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 CM14374 [0,1,0,1,0,0|0,0,2]=4 89 B12R2.196 c1cc2c(c(c1)Br)CCC2=O CM10103 [0,1,0,1,0,0|0,0,2]=4 90 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O CM10362 [0,1,0,1,0,0|0,0,2]=4 91 B12R2.196 c1cc2c(c(c1)F)CCC2=O CM10386 [0,1,0,1,0,0|0,0,2]=4