0 B12R1.16 CCOC(=O)c1cnc(nc1)N CM10697 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.16 c1cc(ccc1C(=O)CCCl)Cl CM11249 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.16 CCOC(=O)c1cccnc1 CM10029 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.22 COC(=O)c1ccc(cc1)N CM12345 [1,0,0,0,0,0|0,0,0]=1 4 B11R1.22 COC(=O)c1cnc(cn1)O CM14417 [1,0,0,0,0,0|3,0,0]=4 5 B11R1.22 COC(=O)c1cnc(nc1)Br CM10434 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.22 COC(=O)c1cnc(nc1)Cl CM14061 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.22 COC(=O)c1cnc(nc1)N CM10696 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.22 c1cc(ccc1C(=O)CBr)Br CM11176 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.22 c1cc(ccc1C(=O)CBr)Cl CM11135 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.22 c1cc(ccc1C(=O)CBr)F CM11141 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.22 c1cc(ccc1C(=O)CN)Br CM11121 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.22 c1cc(ccc1C(=O)NN)Cl CM13812 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.17 c1cc(ccc1C(=O)CCCCl)F CM10030 [0,1,0,0,0,0|2,0,0]=3 14 B13R1.21 CN(C(=O)c1ccc(cc1)F)OC CM13177 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.1511 CCOC(=O)c1ccc(cc1F)Br CM12497 [0,1,0,0,0,0|1,0,0]=2 16 B13R1.1511 CCOC(=O)c1ccc(cc1F)C CM12759 [0,1,0,0,0,0|1,0,0]=2 17 B13R2.5179 c1cc2c(cc1Br)CCCC2=O CM10837 [0,0,0,1,0,0|2,0,0]=3 18 B13R2.5179 c1cc2c(cc1N)CCCC2=O CM10783 [0,0,0,1,0,0|1,0,0]=2 19 B13R2.5187 c1cc2c(cc1F)C(=O)OC2=O CM13827 [0,0,0,1,0,0|2,0,1]=4 20 B11R1.15 CCOC(=O)c1ccc([nH]1)Br CM10423 [0,0,0,0,1,0|2,0,0]=3 21 B11R1.15 CCOC(=O)c1coc(n1)Cl CM10352 [0,0,0,0,1,0|3,0,0]=4 22 B11R1.15 CCOC(=O)c1coc(n1)N CM10351 [0,0,0,0,1,0|2,0,0]=3 23 B13R1.19 CCOC(=O)Cc1ccc(cc1)C CM13729 [0,0,0,0,0,1|1,0,0]=2 24 B10R1.15 CCC(C)c1ccccc1 CM12120 [2,0,0,0,0,0|1,0,1]=4 25 B10R1.15 COC(=O)c1cccnc1 CM10959 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [2,0,0,0,0,0|1,0,0]=3 27 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [2,0,0,0,0,0|1,0,0]=3 29 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [2,0,0,0,0,0|1,0,0]=3 30 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [2,0,0,0,0,0|1,0,0]=3 31 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [2,0,0,0,0,0|1,0,0]=3 33 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [2,0,0,0,0,0|1,0,0]=3 39 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [2,0,0,0,0,0|1,0,0]=3 40 B10R1.13 c1cc(ncc1C(=O)O)N CM10961 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [2,0,0,0,0,0|2,0,0]=4 43 B12R1.17 CCOC(=O)c1cc(=O)[nH]cn1 CM10222 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.17 CCOC(=O)c1cc(cnc1)Br CM14116 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.5 CCc1ccc(cc1)C(=O)CC CM11251 [1,1,0,0,0,0|1,0,0]=3 46 B12R1.5 c1cc(ccc1C#N)C(=O)CBr CM12947 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.367 COC(=O)c1ccc(c(c1)Br)I CM12516 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.367 COC(=O)c1ccc(c(c1)F)N CM12406 [1,1,0,0,0,0|0,0,0]=2 49 B12R1.367 COC(=O)c1ccc(c(c1)I)N CM12418 [1,1,0,0,0,0|0,0,0]=2 50 B12R1.367 COC(=O)c1ccc(c(c1)I)O CM10364 [1,1,0,0,0,0|1,0,0]=3 51 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CM12352 [1,1,0,0,0,0|1,0,0]=3 52 B12R1.367 COC(=O)c1ccc(c(c1)N)O CM12415 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.367 COC(=O)c1ccc(c(c1)O)N CM12416 [1,1,0,0,0,0|0,0,0]=2 54 B12R1.367 c1cc(c(cc1C(=O)CCl)F)F CM11157 [1,1,0,0,0,0|2,0,0]=4 55 B12R1.1703 CCC(=O)c1ccc(cc1F)Br CM10141 [1,1,0,0,0,0|1,0,0]=3 56 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CM13187 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.1703 CNC(=O)c1ccc(cc1F)I CM13186 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CM12459 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.1703 COC(=O)c1ccc(cc1Br)F CM12487 [1,1,0,0,0,0|1,0,0]=3 60 B12R1.1703 COC(=O)c1ccc(cc1Cl)Br CM12464 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.1703 COC(=O)c1ccc(cc1Cl)N CM12362 [1,1,0,0,0,0|0,0,0]=2 62 B12R1.1703 COC(=O)c1ccc(cc1F)Br CM12498 [1,1,0,0,0,0|1,0,0]=3 63 B12R1.1703 COC(=O)c1ccc(cc1F)F CM12656 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.1703 COC(=O)c1ccc(cc1F)I CM12732 [1,1,0,0,0,0|1,0,0]=3 65 B12R1.1703 COC(=O)c1ccc(cc1F)N CM12404 [1,1,0,0,0,0|0,0,0]=2 66 B12R1.1703 COC(=O)c1ccc(cc1F)O CM12714 [1,1,0,0,0,0|1,0,0]=3 67 B12R1.1703 COC(=O)c1ccc(cc1N)Br CM12348 [1,1,0,0,0,0|1,0,0]=3 68 B12R1.1703 COC(=O)c1ccc(cc1N)F CM12395 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.1703 COC(=O)c1ccc(cc1O)F CM12722 [1,1,0,0,0,0|1,0,0]=3 70 B12R1.313 CCOC(=O)c1cc([nH]c1C)C CM10711 [0,1,0,0,1,0|2,0,0]=4 71 B14R1.967 CCOC(=O)Cc1ccc(c(c1)F)Cl CM13672 [0,1,0,0,0,1|1,0,0]=3 72 B14R1.6823 CCOC(=O)Cc1ccc(cc1F)Cl CM13669 [0,1,0,0,0,1|1,0,0]=3 73 B14R1.683 CC(C)(C)OC(=O)c1ccc(cc1)Br CM12450 [0,2,0,0,0,0|1,0,0]=3 74 B14R1.683 CC(C)(C)OC(=O)c1ccc(cc1)O CM12803 [0,2,0,0,0,0|1,0,0]=3 75 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)C#N CM12470 [0,2,0,0,0,0|0,0,1]=3 76 B14R1.6821 CCOC(=O)c1cc(c(c(c1)F)C)N CM12410 [0,2,0,0,0,0|1,0,0]=3 77 B14R1.7264 CCOC(=O)c1cc(c(cc1F)F)F CM12877 [0,2,0,0,0,0|1,0,0]=3 78 B12R2.24 c1cc2c(cc1Br)CCOC2 CM10629 [1,0,0,1,0,0|1,0,1]=4 79 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 CM10829 [1,0,0,1,0,0|2,0,0]=4 80 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 CM13881 [1,0,0,1,0,0|2,0,0]=4 81 B12R2.1081 c1ccc2c(c1)CCOC2=O CM10132 [1,0,0,1,0,0|0,0,0]=2 82 B12R2.612 c1cc2c(cc1Br)CCC2=O CM14359 [1,0,0,1,0,0|1,0,0]=3 83 B12R2.612 c1cc2c(cc1Br)OCC2=O CM10487 [1,0,0,1,0,0|2,0,0]=4 84 B12R2.612 c1cc2c(cc1Cl)OCC2=O CM10772 [1,0,0,1,0,0|2,0,0]=4 85 B12R2.612 c1cc2c(cc1F)CCC2=O CM14361 [1,0,0,1,0,0|1,0,0]=3 86 B12R2.612 c1cc2c(cc1O)OCC2=O CM10744 [1,0,0,1,0,0|2,0,0]=4 87 B10R1.11 CCOC(=O)c1c[nH]cn1 CM14066 [1,0,0,0,1,0|2,0,0]=4 88 B10R1.11 CCOC(=O)c1ccco1 CM10969 [1,0,0,0,1,0|1,0,0]=3 89 B10R1.14 COC(=O)c1cc(sc1)Br CM10537 [1,0,0,0,1,0|2,0,0]=4 90 B14R1.502 CCOC(=O)C#Cc1ccc(cc1)Cl CM13879 [0,0,0,0,0,2|1,0,0]=3 91 B14R1.502 CCOC(=O)C=Cc1ccc(cc1)Cl CM13578 [0,0,0,0,0,2|1,0,0]=3 92 B14R1.502 CCOC(=O)CCc1ccc(cc1)N CM10283 [0,0,0,0,0,2|0,0,0]=2