0 B11R1.3 CC(=O)c1ccc(cc1)CN CUR-0099499 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.3 CC(=O)c1ccc(cc1)OC CUR-0002196 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.3 CC(C)c1ccc(cc1)C#C CUR-0076021 [0,0,0,0,0,0|1,0,1]=2 3 B11R1.3 CC(C)c1ccc(cc1)C=O CUR-0102317 [0,0,0,0,0,0|0,0,2]=2 4 B11R1.3 CCc1ccc(cc1)C(=O)C CUR-0102311 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.3 CN(C)c1ccc(cc1)C=O CUR-0007448 [0,0,0,0,0,0|1,0,2]=3 6 B11R1.3 CN(C)c1ccc(cn1)CCl CUR-0035047 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.3 CN(C)c1ccc(cn1)CCl CUR-0153390 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.3 CN(C)c1ccc(cn1)CN CUR-0016956 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.3 CN(C)c1ccc(cn1)CO CUR-0035032 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.3 c1cc(ccc1CBr)[N+](=O)[O-] CUR-0025401 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.3 c1cc(ccc1CCl)[N+](=O)[O-] CUR-0003298 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.3 c1cc(ccc1CN)C(=O)O CUR-0000478 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.3 CCc1ccc(cc1)C=O CUR-0102034 [1,0,0,0,0,0|0,0,2]=3 14 B10R1.3 CNc1ccc(cc1)NC CUR-0101288 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.3 COc1ccc(cc1)C#N CUR-0102006 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.3 COc1ccc(cc1)C=O CUR-0100790 [1,0,0,0,0,0|1,0,2]=4 17 B10R1.3 COc1ccc(cc1)CCl CUR-0102548 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.3 COc1ccc(cc1)CN CUR-0102099 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.3 COc1ccc(cc1)CO CUR-0102114 [1,0,0,0,0,0|1,0,0]=2 20 B10R1.3 COc1ccc(cc1)NN CUR-0025100 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.3 COc1ccc(cc1)OC CUR-0102112 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.3 COc1ccc(cn1)CN CUR-0022526 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.3 COc1ccc(cn1)CN CUR-0100671 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.3 CSc1ccc(cc1)C=O CUR-0102441 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.3 c1cc(ccc1CCl)C#N CUR-0102414 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.3 c1cc(ccc1CO)CO CUR-0005478 [1,0,0,0,0,0|1,0,0]=2 27 B10R1.13 CC(=O)c1ccc(cc1)Br CUR-0021132 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.13 CC(=O)c1ccc(cc1)Cl CUR-0003490 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.13 CC(=O)c1ccc(cc1)F CUR-0101069 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.13 CC(=O)c1ccc(cc1)I CUR-0103903 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.13 CC(=O)c1ccc(cc1)N CUR-0019746 [1,0,0,0,0,0|2,0,1]=4 32 B10R1.13 CC(=O)c1ccc(cc1)O CUR-0102066 [1,0,0,0,0,0|1,0,1]=3 33 B10R1.13 CC(C)c1ccc(cc1)N CUR-0102054 [1,0,0,0,0,0|1,0,0]=2 34 B10R1.13 CC(C)c1ccc(cc1)O CUR-0102075 [1,0,0,0,0,0|0,0,0]=1 35 B10R1.13 CC(c1ccc(cc1)F)Cl CUR-0009756 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.13 CN(C)c1ccc(cc1)Br CUR-0007999 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.13 CN(C)c1ccc(cc1)N CUR-0025717 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.13 Cc1ccc(cc1)C(=O)C CUR-0102036 [1,0,0,0,0,0|1,0,1]=3 39 B10R1.13 Cc1ccc(cc1)C(=O)Cl CUR-0102507 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.13 Cc1ccc(cc1)C(=O)N CUR-0074413 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.13 Cc1ccc(cc1)C(=O)O CUR-0027993 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.13 Cc1ccc(cc1)C(C)C CUR-0017683 [1,0,0,0,0,0|0,0,0]=1 43 B10R1.13 Cc1ccc(cc1)S(=O)[O-] CUR-0103028 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] CUR-0019978 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.13 c1cc(ccc1C(=O)O)O CUR-0018863 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.13 c1cc(ccc1[N+](=O)[O-])O CUR-0002463 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.5 CC(CN)c1ccc(cc1)OC CUR-0123513 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.5 CCc1ccc(cc1)C(CN)O CUR-0075516 [0,1,0,0,0,0|2,0,0]=3 49 B12R1.5 COC(=O)c1ccc(cc1)CBr CUR-0103789 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.5 COC(=O)c1ccc(cc1)CCl CUR-0023162 [0,1,0,0,0,0|2,0,1]=4 51 B12R1.6 CC(C)(C)c1ccc(cc1)C=C CUR-0102621 [0,1,0,0,0,0|1,0,1]=3 52 B12R1.6 CC(C)(C)c1ccc(cc1)OC CUR-0102730 [0,1,0,0,0,0|2,0,0]=3 53 B12R1.6 CC(C)(C)c1ccc(cn1)C#N CUR-0073275 [0,1,0,0,0,0|2,0,1]=4 54 B12R1.48 CC(c1ccc(c(c1)Cl)OC)Br CUR-0020001 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.113 CN(C)c1ccc(cc1)CCN CUR-0099419 [0,1,0,0,0,0|2,0,0]=3 56 B12R1.256 CC(=O)c1ccc(cc1)C(=O)O CUR-0102712 [0,1,0,0,0,0|1,0,2]=4 57 B12R1.256 CN(C)c1ccc(cc1)C(=O)O CUR-0100843 [0,1,0,0,0,0|1,0,1]=3 58 B12R1.256 CN(C)c1ccc(cn1)C(=O)O CUR-0019701 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.256 CN(C)c1ccc(cn1)C(=O)O CUR-0153401 [0,1,0,0,0,0|2,0,1]=4 60 B12R1.4 CC(C)Oc1ccc(cn1)CCl CUR-0035057 [0,0,0,0,0,1|2,0,0]=3 61 B12R1.4 CC(C)Oc1ccc(cn1)CN CUR-0003653 [0,0,0,0,0,1|2,0,0]=3 62 B12R1.4 CC(C)Oc1ccc(cn1)CO CUR-0035044 [0,0,0,0,0,1|1,0,0]=2 63 B9R1.1 CCc1ccc(cc1)N CUR-0101815 [2,0,0,0,0,0|1,0,0]=3 64 B9R1.1 CCc1ccc(cc1)O CUR-0101831 [2,0,0,0,0,0|0,0,0]=2 65 B9R1.1 CCc1ccc(nc1)C CUR-0101818 [2,0,0,0,0,0|1,0,0]=3 66 B9R1.1 CNc1ccc(cc1)O CUR-0022262 [2,0,0,0,0,0|1,0,0]=3 67 B9R1.1 CNc1ccc(cc1)O CUR-0101222 [2,0,0,0,0,0|1,0,0]=3 68 B9R1.1 COc1ccc(cc1)Cl CUR-0048268 [2,0,0,0,0,0|2,0,0]=4 69 B9R1.1 COc1ccc(cc1)F CUR-0101887 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.1 COc1ccc(cc1)I CUR-0103822 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.1 COc1ccc(cc1)N CUR-0100837 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.1 COc1ccc(cc1)O CUR-0028796 [2,0,0,0,0,0|1,0,0]=3 73 B9R1.1 COc1ccc(cc1)S CUR-0102143 [2,0,0,0,0,0|1,1,0]=4 74 B9R1.1 CSc1ccc(cc1)N CUR-0102131 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.1 Cc1ccc(cc1)C#N CUR-0014965 [2,0,0,0,0,0|1,0,1]=4 76 B9R1.1 Cc1ccc(cc1)C=C CUR-0101785 [2,0,0,0,0,0|0,0,2]=4 77 B9R1.1 Cc1ccc(cc1)C=O CUR-0006736 [2,0,0,0,0,0|0,0,2]=4 78 B9R1.1 Cc1ccc(cc1)CCl CUR-0102151 [2,0,0,0,0,0|1,0,0]=3 79 B9R1.1 Cc1ccc(cc1)CN CUR-0101819 [2,0,0,0,0,0|1,0,0]=3 80 B9R1.1 Cc1ccc(cc1)NN CUR-0013436 [2,0,0,0,0,0|2,0,0]=4 81 B9R1.1 Cc1ccc(cc1)NN CUR-0101391 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.1 Cc1ccc(cc1)NN CUR-0102589 [2,0,0,0,0,0|2,0,0]=4 83 B9R1.1 Cc1ccc(cc1)OC CUR-0101834 [2,0,0,0,0,0|1,0,0]=3 84 B9R1.1 Cc1cnc(cn1)CO CUR-0083373 [2,0,0,0,0,0|2,0,0]=4 85 B9R1.1 c1cc(ccc1C#N)O CUR-0011114 [2,0,0,0,0,0|1,0,1]=4 86 B9R1.1 c1cc(ccc1C=O)O CUR-0004120 [2,0,0,0,0,0|1,0,1]=4 87 B9R1.1 c1cc(ccc1CBr)Br CUR-0103921 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.1 c1cc(ccc1CBr)F CUR-0103233 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.1 c1cc(ccc1CCl)Br CUR-0048248 [2,0,0,0,0,0|2,0,0]=4 90 B9R1.1 c1cc(ccc1CCl)Cl CUR-0100970 [2,0,0,0,0,0|2,0,0]=4 91 B9R1.1 c1cc(ccc1CCl)F CUR-0100845 [2,0,0,0,0,0|2,0,0]=4 92 B9R1.1 c1cc(ccc1CCl)N CUR-0101273 [2,0,0,0,0,0|2,0,0]=4 93 B9R1.1 c1cc(ccc1CN)Br CUR-0103189 [2,0,0,0,0,0|2,0,0]=4 94 B9R1.1 c1cc(ccc1CN)Cl CUR-0102174 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.1 c1cc(ccc1CN)F CUR-0005028 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.1 c1cc(ccc1CN)N CUR-0038242 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.1 c1cc(ccc1CN)O CUR-0100730 [2,0,0,0,0,0|1,0,0]=3 98 B9R1.6 CC(=C)c1ccccc1 CUR-0101783 [2,0,0,0,0,0|0,0,2]=4 99 B9R1.6 CC(=O)c1ccccc1 CUR-0002350 [2,0,0,0,0,0|1,0,1]=4 100 B9R1.6 CC(c1ccccc1)Br CUR-0009957 [2,0,0,0,0,0|1,0,0]=3 101 B9R1.6 CC(c1ccccc1)N CUR-0006791 [2,0,0,0,0,0|1,0,0]=3 102 B9R1.6 CC(c1ccccn1)N CUR-0097687 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.6 CC(c1cccnc1)Cl CUR-0095151 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.6 CC(c1ccncc1)Cl CUR-0026970 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.6 CN(C)c1ccccc1 CUR-0003058 [2,0,0,0,0,0|1,0,0]=3 106 B9R1.6 CN(C)c1ccncc1 CUR-0012964 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.6 C[C@@H](c1ccccc1)N CUR-0100794 [2,0,0,0,0,0|1,0,0]=3 108 B9R1.6 C[C@H](c1ccccc1)N CUR-0019064 [2,0,0,0,0,0|1,0,0]=3 109 B11R1.83 CCOc1ccc(cc1)C=O CUR-0102371 [1,1,0,0,0,0|0,0,2]=4 110 B11R1.83 CCOc1ccc(cn1)CN CUR-0065820 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.83 CCc1ccc(cc1)CCBr CUR-0006765 [1,1,0,0,0,0|1,0,0]=3 112 B11R1.83 COc1ccc(cc1)CC#N CUR-0102300 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.83 COc1ccc(cc1)CC=O CUR-0048309 [1,1,0,0,0,0|1,0,1]=4 114 B11R1.83 COc1ccc(cc1)CCCl CUR-0102873 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.83 COc1ccc(cc1)CCN CUR-0102406 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.83 COc1ccc(cc1)CCN CUR-0103214 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.83 COc1ccc(cc1)CNN CUR-0098475 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.19 CC(C)(C)c1ccc(cc1)N CUR-0100148 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.19 CC(C)(C)c1ccc(cc1)O CUR-0102376 [1,1,0,0,0,0|0,0,0]=2 120 B11R1.19 CC(C)(C)c1ccc(cn1)N CUR-0096555 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.21 Cc1ccc(cc1C)C(=O)C CUR-0100013 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.21 Cc1ccc(cc1O)C(C)C CUR-0012406 [1,1,0,0,0,0|0,0,0]=2 123 B11R1.22 CC(c1ccc(cc1)Br)NN CUR-0021938 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.22 CC(c1ccc(cc1)Cl)NN CUR-0012401 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.22 CCC(=O)c1ccc(cc1)C CUR-0102313 [1,1,0,0,0,0|1,0,1]=4 126 B11R1.22 CCC(=O)c1ccc(cc1)O CUR-0102358 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.22 COC(=O)c1ccc(cc1)O CUR-0102420 [1,1,0,0,0,0|1,0,1]=4 128 B11R1.22 Cc1ccc(cc1)C(=O)OC CUR-0027548 [1,1,0,0,0,0|1,0,1]=4 129 B11R1.22 Cc1ccc(cc1)C(C#C)O CUR-0048969 [1,1,0,0,0,0|1,0,1]=4 130 B11R1.166 CC(=O)c1ccc(cc1O)O CUR-0102423 [1,1,0,0,0,0|1,0,1]=4 131 B11R1.166 Cc1cc(ccc1C(C)C)O CUR-0102380 [1,1,0,0,0,0|0,0,0]=2 132 B11R1.166 Cc1ccc(c(c1)C)C(=O)C CUR-0102312 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.166 Cc1ccc(c(c1)O)C(C)C CUR-0002437 [1,1,0,0,0,0|0,0,0]=2 134 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)C CUR-0103005 [0,1,0,0,0,1|0,0,2]=4 135 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)O CUR-0103075 [0,1,0,0,0,1|0,0,1]=3 136 B13R1.585 CC(C)Oc1ccc(cn1)C(=O)O CUR-0000945 [0,1,0,0,0,1|1,0,1]=4 137 B13R1.585 CC(C)Sc1ccc(cc1)C(=O)O CUR-0098247 [0,1,0,0,0,1|0,0,1]=3 138 B13R1.537 CC(C)c1ccc(cc1)C(C)NN CUR-0007803 [0,2,0,0,0,0|1,0,0]=3 139 B13R1.96 CC(C)(C)c1ccc(cc1O)C=O CUR-0144516 [0,2,0,0,0,0|0,0,2]=4 140 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)C CUR-0103004 [0,2,0,0,0,0|0,0,2]=4 141 B13R1.338 CC(C)(C)c1ccc(cc1)C(=O)Cl CUR-0101029 [0,2,0,0,0,0|0,0,2]=4 142 B13R1.338 CC(C)(C)c1ccc(cc1)C(=O)O CUR-0101004 [0,2,0,0,0,0|0,0,1]=3 143 B13R1.338 CC(C)(C)c1ccc(cn1)C(=O)O CUR-0096554 [0,2,0,0,0,0|1,0,1]=4 144 B13R1.338 CC(C)c1ccc(cc1)S(=O)(=O)N CUR-0074167 [0,2,0,0,0,0|1,0,1]=4 145 B11R2.21 c1c(n[nH]c1C2CC2)CO CUR-0029227 [0,0,0,1,1,0|2,0,0]=4 146 B13R2.185 c1cc(ccc1C=O)C2CCC2 CUR-0024913 [0,1,0,1,0,0|0,0,2]=4 147 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 CUR-0018165 [0,1,0,1,0,0|1,0,1]=4 148 B9R1.21 c1cc(oc1CN)CO CUR-0013378 [1,0,0,0,1,0|2,0,0]=4 149 B11R1.20 CC(=O)Nc1ccc(cc1)O CUR-0102405 [1,0,0,0,0,1|1,0,1]=4 150 B11R1.20 Cc1ccc(cc1)NC(=O)C CUR-0007058 [1,0,0,0,0,1|1,0,1]=4 151 B11R1.266 CN(C)c1cc(ccn1)CN CUR-0001678 [0,0,0,0,1,1|2,0,0]=4