0 B10R1.113 CC(=O)c1cc(ccn1)Cl CM10835 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.113 CC(C)c1cccc(n1)Br CM13845 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.113 CN(C)c1cccc(n1)Br CM10139 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.113 CN(C)c1ccnc(c1)Br CM10679 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.113 Cc1cncc(n1)C(=O)O CM14090 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.113 c1c(nc(cn1)Br)C(=O)O CM10659 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.113 c1c(nc(cn1)Cl)C(=O)O CM10658 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.113 c1cc(cc(c1)F)C(=O)O CM12710 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.113 c1cc(cc(c1)N)C(=O)N CM13163 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.113 c1cc(cc(c1)S)C(=O)O CM10051 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.113 c1cc(nc(c1)Cl)C(=O)O CM10033 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.113 c1cnc(cc1C(=O)O)N CM14043 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.113 c1cnc(nc1C(=O)O)N CM14051 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.2 COc1ccnc(n1)Br CM10844 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.2 COc1ccnc(n1)N CM10846 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.2 CSc1cccc(n1)Br CM10114 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.2 c1cnc(nc1C#N)Br CM10923 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.2 c1cnc(nc1C#N)Cl CM10118 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.6 c1ccnc(c1)C(=N)N CM13839 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.6 c1cncnc1C(=O)O CM10263 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br CM11175 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.21 CC(=O)c1ccc(c(c1)Br)F CM11144 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl CM11181 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F CM11161 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.21 CC(=O)c1ccc(c(c1)F)Br CM11146 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl CM11164 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.21 CC(=O)c1ccc(c(c1)F)O CM11200 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl CM11123 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.21 CC(=O)c1ccc(c(c1)N)F CM11126 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.21 Cc1cc(ccc1Cl)C(=O)Cl CM12596 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.21 Cc1cc(ccc1F)C(=O)C CM11205 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.21 Cc1cc(ccc1O)C(=O)O CM12806 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.23 CCC(=O)c1cccc(c1)N CM11248 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.23 COC(=O)c1cccc(c1)I CM12817 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.23 COC(=O)c1cccc(c1)N CM12344 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.23 COC(=O)c1cccc(c1)O CM12802 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.23 COC(=O)c1cncc(n1)Br CM10424 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.23 COC(=O)c1cncc(n1)Cl CM10425 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.23 c1cc(cc(c1)O)C(=O)CBr CM11149 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br CM11177 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl CM11182 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F CM11162 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.74 CC(=O)c1cc(cc(c1)F)F CM11190 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.74 CC(C)c1cc(nc(n1)N)Cl CM14126 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.74 Cc1cc(cc(c1)C(=O)O)C CM12703 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.74 Cc1cc(cc(c1)N)C(=O)O CM12429 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.155 CS(=O)(=O)c1cccc(n1)Br CM10122 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.159 CC(=O)c1cccc(c1Cl)Cl CM11179 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.159 CC(=O)c1cccc(c1F)Br CM11143 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.159 CC(=O)c1cccc(c1F)F CM10559 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.159 CC(=O)c1cccc(c1N)Br CM11120 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.159 Cc1cccc(c1Br)C(=O)O CM12530 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.159 Cc1cccc(c1C)C(=O)Cl CM12700 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.159 Cc1cccc(c1F)C(=O)O CM12758 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.159 Cc1cccc(c1I)C(=O)O CM12822 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.167 CC(=O)c1cc(ccc1Br)F CM10079 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.167 CC(=O)c1cc(ccc1Cl)F CM11159 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.167 CC(=O)c1cc(ccc1F)Br CM11147 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.167 CC(=O)c1cc(ccc1I)F CM11201 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.167 Cc1ccc(c(c1)C(=O)N)N CM13166 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br CM12531 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.167 Cc1ccc(c(c1)C(=O)O)C CM12701 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl CM12592 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.167 Cc1ccc(c(c1)C(=O)O)F CM12761 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.167 Cc1ccc(c(c1)C(=O)O)I CM12821 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br CM10692 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.167 c1cc(nc(c1N)C(=O)N)Cl CM14027 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.266 CC(=O)c1cccc(c1)C#N CM12899 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.266 COc1cc(ncn1)C(=O)O CM10693 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.266 COc1cncc(n1)C(=O)O CM10660 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.266 c1cc(nc(c1)C(=O)N)CO CM13854 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.35 Cn1ccc(c1)C(=O)O CM10465 [0,0,0,0,1,0|3,0,0]=4 77 B11R1.157 Cc1cccc(c1)CC(=O)O CM13725 [0,0,0,0,0,1|3,0,0]=4 78 B8R1.4 Cc1cccc(n1)Br CM14044 [2,0,0,0,0,0|2,0,0]=4 79 B8R1.4 Cc1ccnc(n1)Cl CM13850 [2,0,0,0,0,0|1,0,0]=3 80 B8R1.4 c1cnc(nc1Br)Br CM10427 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.4 c1cnc(nc1Br)Cl CM10078 [2,0,0,0,0,0|2,0,0]=4 82 B8R1.4 c1cnc(nc1Br)N CM10436 [2,0,0,0,0,0|2,0,0]=4 83 B8R1.4 c1cnc(nc1N)Br CM10437 [2,0,0,0,0,0|2,0,0]=4 84 B10R1.2 Cc1cccc(c1Cl)C=O CM11894 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.2 Cc1cccc(c1F)C=O CM11968 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.8 Cc1cc(cc(c1)Cl)C=O CM11896 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.8 Cc1cc(cc(c1)F)C=O CM11973 [1,1,0,0,0,0|2,0,0]=4 88 B10R1.8 Cc1cc(cc(c1)O)C=O CM10898 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.8 Cc1nc(cc(n1)Cl)OC CM14055 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.30 CSc1c(cnc(n1)Cl)Br CM10432 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.30 Cc1ccc(c(c1)C=O)F CM11970 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.172 COc1ccnc(c1)CN CM10131 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.172 c1cc(nc(c1)C=O)C=O CM14110 [1,1,0,0,0,0|1,0,1]=4 94 B10R1.176 Cc1cc(ccc1Cl)C=O CM11897 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.176 Cc1cc(ccc1O)C=O CM11993 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.176 Cc1ccc(cc1C)C=O CM11941 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.61 CC(=O)c1ccccc1Br CM11134 [1,1,0,0,0,0|2,0,0]=4 105 B10R1.61 CC(=O)c1ccccc1I CM11218 [1,1,0,0,0,0|2,0,0]=4 106 B12R1.438 CC(=O)Cc1cccc(c1)OC CM11254 [0,1,0,0,0,1|2,0,0]=4 107 B12R1.48 Cc1cc(ccc1C#N)C(=O)C CM11174 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.56 CC(=O)c1ccc(c(c1)OC)F CM11204 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.56 CC(=O)c1ccc(c(c1)OC)O CM10957 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.367 Cc1c(ncc(n1)C(=O)OC)Cl CM10047 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.24 Cc1cccc(c1Br)C(=O)OC CM12529 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.24 Cc1cccc(c1F)C(=O)OC CM12757 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.358 Cc1cc(cc(n1)Cl)C(=O)OC CM11010 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.435 COC(=O)c1cccc(c1)CN CM12426 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.435 COC(=O)c1cccc(n1)CO CM13855 [0,2,0,0,0,0|1,0,0]=3 116 B12R1.258 CC(=O)c1cccc(n1)C(=O)C CM14426 [0,2,0,0,0,0|1,0,0]=3 117 B8R1.11 c1csc(c1C=O)Br CM10421 [1,0,0,0,1,0|2,0,0]=4 118 B8R1.7 c1c(nc[nH]1)C(=O)O CM14067 [1,0,0,0,1,0|1,0,1]=4 119 B8R1.7 c1cn[nH]c1C(=O)O CM11038 [1,0,0,0,1,0|1,0,1]=4