0 B12R1.16 CCOC(=O)c1ccc(cc1)F ACT01143 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.16 CCOC(=O)c1ccc(cc1)I ACT08383 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.16 CCOC(=O)c1cnc(nc1)Cl ACT10943 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.16 CCOC(=O)c1ccccn1 ACT11795 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.16 CCOC(=O)c1cccnc1 ACT11796 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.16 CCOC(=O)c1ccncc1 ACT11797 [1,0,0,0,0,0|1,0,0]=2 6 B11R1.22 COC(=O)c1ccc(cc1)I ACT01140 [1,0,0,0,0,0|1,0,0]=2 7 B11R1.22 COC(=O)c1ccc(cn1)Br ACT11225 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.22 COC(=O)c1ccc(cn1)Cl ACT11226 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.22 COC(=O)c1ccc(nc1)N ACT11746 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.22 COC(=O)c1cnc(cn1)Cl ACT01750 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.22 COC(=O)c1cnc(cn1)O ACT11003 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.22 Cc1ccc(cn1)C(=O)OC ACT02408 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.22 c1cc(ccc1C(=O)CBr)N ACT09355 [1,0,0,0,0,0|1,0,0]=2 14 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C ACT05669 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.29 CCOS(=O)(=O)c1ccc(cc1)C ACT05682 [0,1,0,0,0,0|2,0,0]=3 16 B13R1.452 CCOC(=O)c1ccc(cc1)NN ACT11379 [0,1,0,0,0,0|0,0,0]=1 17 B13R1.452 CCOC(=O)c1cnc(nc1)SC ACT04574 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.466 CCOC(=O)c1ccc(c(c1)I)O ACT08956 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.466 c1cc(c(cc1C(=O)CCCl)Cl)Cl ACT09601 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.1511 CCOC(=O)c1ccc(=O)[nH]c1C ACT09565 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.1511 CCOC(=O)c1ccc(nc1Cl)Cl ACT11258 [0,1,0,0,0,0|2,0,0]=3 22 B13R1.1511 CCOC(=O)c1cnc(nc1Cl)Cl ACT01408 [0,1,0,0,0,0|3,0,0]=4 23 B13R2.520 c1cc(ccc1C(=O)C2CC2)Br ACT10065 [0,0,0,1,0,0|2,0,0]=3 24 B13R2.5179 c1cc2c(cc1F)CCNC2=O ACT09234 [0,0,0,1,0,0|2,0,0]=3 25 B11R1.15 CCOC(=O)c1cnc(s1)Br ACT02346 [0,0,0,0,1,0|3,0,0]=4 26 B11R1.15 CCOC(=O)c1cnc(s1)Cl ACT08902 [0,0,0,0,1,0|3,0,0]=4 27 B11R1.15 CCOC(=O)c1cnc(s1)N ACT02338 [0,0,0,0,1,0|2,0,0]=3 28 B11R1.15 CCOC(=O)c1csc(n1)N ACT02337 [0,0,0,0,1,0|2,0,0]=3 29 B13R1.19 c1cc(ccc1NC(=O)CCCl)O ACT09191 [0,0,0,0,0,1|3,0,0]=4 30 B10R1.1 CCOc1cnc(nc1)N ACT09665 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.15 COC(=O)c1ccccn1 ACT11786 [2,0,0,0,0,0|1,0,0]=3 32 B10R1.15 COC(=O)c1cccnc1 ACT11790 [2,0,0,0,0,0|1,0,0]=3 33 B10R1.15 COC(=O)c1ccncc1 ACT11792 [2,0,0,0,0,0|1,0,0]=3 34 B10R1.13 B(c1ccc(cc1)N)(O)O ACT11284 [2,0,0,0,0,0|1,0,1]=4 35 B10R1.13 CC(=O)c1ccc(cc1)I ACT08155 [2,0,0,0,0,0|1,0,0]=3 36 B10R1.13 CC(=O)c1ccc(cc1)O ACT01160 [2,0,0,0,0,0|1,0,0]=3 37 B10R1.13 CC(=O)c1ccc(nc1)Br ACT01536 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.13 CN(C)c1ccc(cc1)N ACT05021 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.13 Cc1ccc(cn1)C(=O)O ACT02455 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.13 c1cc(ccc1C(=N)N)N ACT05196 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.13 c1cc(ccc1C(=O)Cl)I ACT03270 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.13 c1cc(ccc1C(=O)O)I ACT00967 [2,0,0,0,0,0|1,0,0]=3 43 B10R1.13 c1cc(ncc1Br)C(=O)O ACT11224 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.13 c1cc(ncc1C(=O)O)Cl ACT02407 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.13 c1cc(ncc1C(=O)O)F ACT02405 [2,0,0,0,0,0|2,0,0]=4 46 B10R1.13 c1cc(ncc1C(=O)O)N ACT02453 [2,0,0,0,0,0|1,0,0]=3 47 B10R1.13 c1cc(ncc1C(=O)O)O ACT04597 [2,0,0,0,0,0|2,0,0]=4 48 B10R1.13 c1cc(ncc1Cl)C(=O)O ACT11221 [2,0,0,0,0,0|2,0,0]=4 49 B10R1.13 c1cc(ncc1F)C(=O)O ACT11242 [2,0,0,0,0,0|2,0,0]=4 50 B12R1.17 CCOC(=O)c1cccc(c1)N ACT00276 [1,1,0,0,0,0|0,0,0]=2 51 B12R1.308 CCOC(=O)c1ccccc1Br ACT11894 [1,1,0,0,0,0|0,0,0]=2 52 B12R1.308 CCOC(=O)c1cccnc1Cl ACT02428 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.308 CCOC(=O)c1cccnc1N ACT04504 [1,1,0,0,0,0|1,0,0]=3 54 B12R1.308 CCOC(=O)c1ccncc1N ACT04454 [1,1,0,0,0,0|1,0,0]=3 55 B12R1.5 COC(=O)c1ccc(cc1)CBr ACT01178 [1,1,0,0,0,0|1,0,0]=3 56 B12R1.9 Cc1ccc(cc1)S(=O)(=O)OC ACT05679 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.12 CCN(CC)c1ccc(cc1)N ACT05010 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.20 CC(C(=O)c1ccc(cc1)F)Br ACT04702 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.367 COC(=O)c1cc(c(nc1)Cl)Br ACT02448 [1,1,0,0,0,0|2,0,0]=4 60 B12R1.367 Cc1ccc(cc1N)C(=O)OC ACT07499 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.1703 COC(=O)c1ccc(nc1Cl)Cl ACT11257 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.1703 COC(=O)c1cnc(cc1Cl)Cl ACT04491 [1,1,0,0,0,0|2,0,0]=4 63 B12R1.1703 Cc1cc(ccc1C(=O)OC)Br ACT00613 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.1703 Cc1cc(cnc1C(=O)OC)Br ACT09233 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CCl ACT11923 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.313 CCOC(=O)c1c(sc(n1)N)Br ACT08471 [0,1,0,0,1,0|2,0,0]=4 67 B12R1.1579 CCOC(=O)c1cnc(n1C)N ACT09141 [0,1,0,0,1,0|2,0,0]=4 68 B14R1.35 CCOC(=O)C(=O)c1ccc(cc1)Cl ACT09988 [0,1,0,0,0,1|1,0,0]=3 69 B14R1.35 CCOC(=O)C(c1ccc(cc1)F)Br ACT10112 [0,1,0,0,0,1|1,0,0]=3 70 B14R1.683 CC(C)(C)OC(=O)c1ccc(cc1)Br ACT01086 [0,2,0,0,0,0|1,0,0]=3 71 B12R2.1081 c1cc2c(nc1)C(=O)CCC2 ACT09162 [1,0,0,1,0,0|2,0,0]=4 72 B12R2.2028 c1ccc2c(c1)C(=O)OI2O ACT08156 [1,0,0,1,0,0|2,0,0]=4 73 B12R2.612 c1cc2c(cc1Br)CCC2=O ACT02586 [1,0,0,1,0,0|1,0,0]=3 74 B12R2.612 c1cc2c(cc1Cl)CCC2=O ACT02585 [1,0,0,1,0,0|1,0,0]=3 75 B12R2.612 c1cc2c(cc1Cl)COC2=O ACT09470 [1,0,0,1,0,0|1,0,0]=3 76 B12R2.612 c1cc2c(cc1F)CCC2=O ACT08254 [1,0,0,1,0,0|1,0,0]=3 77 B14R2.8719 c1cc2c(cc1Br)CCCCC2=O ACT09091 [0,1,0,1,0,0|2,0,0]=4 78 B10R1.11 CCOC(=O)c1c[nH]cn1 ACT09368 [1,0,0,0,1,0|2,0,0]=4 79 B10R1.11 CCOC(=O)c1c[nH]nc1 ACT01767 [1,0,0,0,1,0|2,0,0]=4 80 B10R1.11 CCOC(=O)c1ccc[nH]1 ACT01682 [1,0,0,0,1,0|1,0,0]=3 81 B10R1.11 CCOC(=O)c1cscn1 ACT07238 [1,0,0,0,1,0|2,0,0]=4 82 B10R1.14 COC(=O)c1cc(c[nH]1)Br ACT01690 [1,0,0,0,1,0|2,0,0]=4 83 B10R1.14 COC(=O)c1ccc(o1)Br ACT11325 [1,0,0,0,1,0|2,0,0]=4 84 B12R1.32 CCOC(=O)Cc1cccnc1 ACT03451 [1,0,0,0,0,1|1,0,0]=3