0 B10R1.17 CCNCc1ccccc1 CUR-0102061 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.17 c1ccc(cc1)CCC#N CUR-0101979 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.17 c1ccc(cc1)CCC=O CUR-0008089 [0,0,0,0,0,0|1,1,1]=3 3 B10R1.17 c1ccc(cc1)CCCBr CUR-0021887 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.17 c1ccc(cc1)CCCN CUR-0102060 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.17 c1ccc(cc1)CCNN CUR-0021770 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 c1ccc(cc1)CN=C=O CUR-0102011 [0,0,0,0,0,0|0,1,0]=1 7 B10R1.17 c1ccc(cc1)CN=C=S CUR-0102333 [0,0,0,0,0,0|0,0,0]=0 8 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] CUR-0100840 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.17 c1ccc(cc1)COCCl CUR-0026033 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.17 c1ccc(cc1)NCCO CUR-0102101 [0,0,0,0,0,0|2,1,1]=4 11 B10R1.17 c1ccc(cc1)OCCBr CUR-0014829 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 c1ccc(cc1)OCCN CUR-0096957 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 c1ccc(cc1)OCCO CUR-0100864 [0,0,0,0,0,0|2,1,1]=4 14 B10R1.17 c1ccc(cc1)\C=C\C#N CUR-0101947 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.17 c1ccc(cc1)\C=C\CCl CUR-0102450 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.8 CCNc1ccccc1 CUR-0000606 [1,0,0,0,0,0|1,0,2]=4 17 B9R1.8 CCOc1ccccc1 CUR-0022022 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.8 CCSc1ccccc1 CUR-0102116 [1,0,0,0,0,0|2,0,1]=4 19 B9R1.8 CNCc1ccccc1 CUR-0014590 [1,0,0,0,0,0|0,0,2]=3 20 B9R1.8 CNCc1cccnc1 CUR-0029160 [1,0,0,0,0,0|1,0,2]=4 21 B9R1.8 CNCc1ccncc1 CUR-0029135 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.8 c1cc(cnc1)N=[N+]=[N-] CUR-0120559 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.8 c1ccc(cc1)CC#N CUR-0026888 [1,0,0,0,0,0|1,0,1]=3 24 B9R1.8 c1ccc(cc1)CC=O CUR-0101800 [1,0,0,0,0,0|0,1,1]=3 25 B9R1.8 c1ccc(cc1)CCBr CUR-0103169 [1,0,0,0,0,0|1,0,1]=3 26 B9R1.8 c1ccc(cc1)CCCl CUR-0006599 [1,0,0,0,0,0|1,0,1]=3 27 B9R1.8 c1ccc(cc1)CCN CUR-0101814 [1,0,0,0,0,0|1,0,1]=3 28 B9R1.8 c1ccc(cc1)CCO CUR-0012636 [1,0,0,0,0,0|0,1,1]=3 29 B9R1.8 c1ccc(cc1)CNN CUR-0008775 [1,0,0,0,0,0|1,0,1]=3 30 B9R1.8 c1ccc(cc1)CON CUR-0102606 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 c1ccc(cc1)N=C=O CUR-0101790 [1,0,0,0,0,0|0,1,0]=2 32 B9R1.8 c1ccc(cc1)N=C=S CUR-0009905 [1,0,0,0,0,0|0,0,0]=1 33 B9R1.8 c1ccnc(c1)CC#N CUR-0100818 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.8 c1ccnc(c1)CNN CUR-0004430 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.8 c1ccnc(c1)\C=N\O CUR-0101824 [1,0,0,0,0,0|1,1,1]=4 36 B9R1.8 c1cnccc1CCN CUR-0097215 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.8 c1cnccc1CNN CUR-0019570 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.1 CCCCc1ccc(cc1)N CUR-0102339 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.1 c1cc(ccc1CN=C=O)Cl CUR-0043225 [0,1,0,0,0,0|0,1,0]=2 40 B11R1.1 c1cc(ccc1CN=C=O)F CUR-0098954 [0,1,0,0,0,0|0,1,0]=2 41 B11R1.16 CC(CC=O)c1ccccc1 CUR-0102318 [0,1,0,0,0,0|1,1,1]=4 42 B11R1.24 CCNCc1cccc(c1)O CUR-0099154 [0,1,0,0,0,0|1,0,2]=4 43 B11R1.24 Cc1cccc(c1)CCNC CUR-0071586 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.28 CCCCNc1ccccc1 CUR-0102338 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.28 CNCCCc1ccccc1 CUR-0099115 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.28 c1ccc(cc1)CCN=C=O CUR-0102299 [0,1,0,0,0,0|0,1,0]=2 47 B11R1.28 c1ccc(cc1)CNCCO CUR-0002096 [0,1,0,0,0,0|0,1,2]=4 48 B11R1.28 c1ccc(cc1)COCCN CUR-0029134 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.28 c1ccc(cc1)COCCO CUR-0102437 [0,1,0,0,0,0|1,1,1]=4 50 B11R1.28 c1ccc(cc1)NCCC#N CUR-0102285 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.28 c1ccc(cc1)NCCCN CUR-0028802 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.28 c1ccc(cc1)OCCCBr CUR-0026681 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.28 c1ccc(cc1)OCCNN CUR-0099002 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.40 c1ccc(cc1)CC(=O)CO CUR-0026508 [0,1,0,0,0,0|1,1,1]=4 55 B11R1.40 c1ccc(cc1)CC(C#N)N CUR-0100492 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.40 c1ccc(cc1)C\C(=N\O)\N CUR-0097985 [0,1,0,0,0,0|2,1,0]=4 57 B11R1.91 CC(=O)CCc1ccccc1 CUR-0102315 [0,1,0,0,0,0|1,1,1]=4 58 B11R1.91 CC(C)NCc1ccccc1 CUR-0102340 [0,1,0,0,0,0|1,0,2]=4 59 B11R1.91 CC(CCc1ccccc1)Br CUR-0007729 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.91 CC(CCc1ccccc1)N CUR-0102337 [0,1,0,0,0,0|2,0,1]=4 61 B11R1.91 c1ccc(cc1)CCC(=N)N CUR-0100997 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.91 c1ccc(cc1)CCC(=O)O CUR-0101118 [0,1,0,0,0,0|1,1,1]=4 63 B11R1.91 c1ccc(cc1)CNC(=O)N CUR-0102373 [0,1,0,0,0,0|0,1,2]=4 64 B11R1.91 c1ccc(cc1)CNC(=S)N CUR-0102793 [0,1,0,0,0,0|0,0,2]=3 65 B11R1.91 c1ccc(cc1)COC(=O)Cl CUR-0001016 [0,1,0,0,0,0|1,1,1]=4 66 B11R1.91 c1ccc(cc1)COC(=O)N CUR-0019394 [0,1,0,0,0,0|1,1,1]=4 67 B11R2.1 c1ccc2c(c1)CCC2=O CUR-0101990 [0,0,0,1,0,0|1,1,1]=4 68 B11R2.1 c1ccc2c(c1)COC2=O CUR-0096090 [0,0,0,1,0,0|1,1,1]=4 69 B11R2.1 c1ccc2c(c1)c(no2)N CUR-0096791 [0,0,0,1,0,0|2,0,1]=4 70 B11R2.1 c1ccc2c(c1)c(ns2)Cl CUR-0102840 [0,0,0,1,0,0|2,0,1]=4 71 B11R2.1 c1ccc2c(c1)nnn2O CUR-0015141 [0,0,0,1,0,0|2,1,0]=4 72 B11R2.1 c1ccc2c(c1)nnn2O CUR-0102463 [0,0,0,1,0,0|2,1,0]=4 73 B11R2.4 c1ccc(cc1)C2CC2N CUR-0089464 [0,0,0,1,0,0|2,0,1]=4 74 B11R2.20 c1ccc2c(c1)CCCC2 CUR-0012227 [0,0,0,1,0,0|2,0,1]=4 75 B11R2.20 c1ccc2c(c1)CCCN2 CUR-0021872 [0,0,0,1,0,0|2,0,1]=4 76 B11R2.20 c1ccc2c(c1)CCNC2 CUR-0010961 [0,0,0,1,0,0|1,0,2]=4 77 B11R2.20 c1ccc2cnccc2c1 CUR-0013173 [0,0,0,1,0,0|1,0,2]=4 78 B9R1.12 c1cc(sc1)CN=C=O CUR-0043228 [0,0,0,0,1,0|1,1,0]=3 79 B8R1.2 C#Cc1ccccc1 CUR-0028923 [2,0,0,0,0,0|0,0,2]=4 80 B8R1.2 C=Cc1ccccc1 CUR-0016228 [2,0,0,0,0,0|0,0,2]=4 81 B8R1.2 CCc1ccccc1 CUR-0101653 [2,0,0,0,0,0|0,0,1]=3 82 B8R1.2 CNc1ccccc1 CUR-0101656 [2,0,0,0,0,0|0,0,2]=4 83 B8R1.2 COc1ccccc1 CUR-0026843 [2,0,0,0,0,0|1,0,1]=4 84 B8R1.2 CSc1ccccc1 CUR-0101870 [2,0,0,0,0,0|1,0,1]=4 85 B8R1.2 c1cc(cnc1)CCl CUR-0002750 [2,0,0,0,0,0|2,0,0]=4 86 B8R1.2 c1cc(cnc1)CN CUR-0027066 [2,0,0,0,0,0|1,0,1]=4 87 B8R1.2 c1cc(cnc1)CO CUR-0101674 [2,0,0,0,0,0|1,1,0]=4 88 B8R1.2 c1ccc(cc1)C#N CUR-0014272 [2,0,0,0,0,0|0,0,2]=4 89 B8R1.2 c1ccc(cc1)C=O CUR-0027632 [2,0,0,0,0,0|0,1,1]=4 90 B8R1.2 c1ccc(cc1)CBr CUR-0024935 [2,0,0,0,0,0|1,0,0]=3 91 B8R1.2 c1ccc(cc1)CCl CUR-0014141 [2,0,0,0,0,0|1,0,0]=3 92 B8R1.2 c1ccc(cc1)CN CUR-0009810 [2,0,0,0,0,0|0,0,1]=3 93 B8R1.2 c1ccc(cc1)CN CUR-0101294 [2,0,0,0,0,0|0,0,1]=3 94 B8R1.2 c1ccc(cc1)CO CUR-0002024 [2,0,0,0,0,0|0,1,0]=3 95 B8R1.2 c1ccc(cc1)CS CUR-0005953 [2,0,0,0,0,0|0,0,1]=3 96 B8R1.2 c1ccc(cc1)NN CUR-0008900 [2,0,0,0,0,0|1,0,1]=4 97 B8R1.2 c1ccc(cc1)NN CUR-0101278 [2,0,0,0,0,0|1,0,1]=4 98 B8R1.2 c1ccnc(c1)CCl CUR-0006464 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.2 c1ccnc(c1)CN CUR-0101659 [2,0,0,0,0,0|1,0,1]=4 100 B8R1.2 c1ccnc(c1)CO CUR-0101669 [2,0,0,0,0,0|1,1,0]=4 101 B8R1.2 c1cnccc1CCl CUR-0005638 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.2 c1cnccc1CN CUR-0101658 [2,0,0,0,0,0|1,0,1]=4 103 B8R1.2 c1cnccc1CO CUR-0101670 [2,0,0,0,0,0|1,1,0]=4 104 B10R1.1 Cc1ccc(cc1)CC#N CUR-0101981 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.1 Cc1ccc(cc1)CNN CUR-0119958 [1,1,0,0,0,0|1,0,1]=4 106 B10R1.1 Cc1ccc(cc1)N=C=O CUR-0102008 [1,1,0,0,0,0|0,1,0]=3 107 B10R1.1 c1cc(ccc1CC#N)Br CUR-0101290 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.1 c1cc(ccc1CC#N)Cl CUR-0016177 [1,1,0,0,0,0|1,0,1]=4 109 B10R1.1 c1cc(ccc1CC#N)F CUR-0102050 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.1 c1cc(ccc1CCBr)Br CUR-0048359 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.1 c1cc(ccc1CCN)Cl CUR-0102529 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.1 c1cc(ccc1CCN)F CUR-0102128 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.1 c1cc(ccc1CCO)Br CUR-0103457 [1,1,0,0,0,0|0,1,1]=4 114 B10R1.1 c1cc(ccc1CCO)Cl CUR-0046489 [1,1,0,0,0,0|0,1,1]=4 115 B10R1.1 c1cc(ccc1CCO)F CUR-0102141 [1,1,0,0,0,0|0,1,1]=4 116 B10R1.1 c1cc(ccc1CCO)N CUR-0102103 [1,1,0,0,0,0|0,1,1]=4 117 B10R1.1 c1cc(ccc1CCO)O CUR-0102110 [1,1,0,0,0,0|0,1,1]=4 118 B10R1.1 c1cc(ccc1CNN)Cl CUR-0098842 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.1 c1cc(ccc1CNN)F CUR-0097664 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.1 c1cc(ccc1N=C=O)Cl CUR-0102474 [1,1,0,0,0,0|0,1,0]=3 121 B10R1.1 c1cc(ccc1N=C=O)F CUR-0102087 [1,1,0,0,0,0|0,1,0]=3 122 B10R1.1 c1cc(ccc1N=C=S)F CUR-0102465 [1,1,0,0,0,0|0,0,0]=2 123 B10R1.4 C=CCc1ccccc1O CUR-0020961 [1,1,0,0,0,0|1,0,1]=4 124 B10R1.4 Cc1ccccc1N=C=S CUR-0102335 [1,1,0,0,0,0|0,0,0]=2 125 B10R1.4 c1ccc(c(c1)CNN)Cl CUR-0098841 [1,1,0,0,0,0|1,0,1]=4 126 B10R1.4 c1ccc(c(c1)N=C=O)F CUR-0096804 [1,1,0,0,0,0|0,1,0]=3 127 B10R1.10 Cc1cccc(c1)CNN CUR-0098840 [1,1,0,0,0,0|1,0,1]=4 128 B10R1.10 Cc1cccc(c1)N=C=O CUR-0102009 [1,1,0,0,0,0|0,1,0]=3 129 B10R1.10 c1cc(cc(c1)Br)CNN CUR-0083740 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.10 c1cc(cc(c1)Cl)CNN CUR-0098843 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.10 c1cc(cc(c1)Cl)N=C=O CUR-0102473 [1,1,0,0,0,0|0,1,0]=3 132 B10R1.10 c1cc(cc(c1)F)CNN CUR-0097665 [1,1,0,0,0,0|1,0,1]=4 133 B10R1.15 CC(C=O)c1ccccc1 CUR-0102035 [1,1,0,0,0,0|0,1,1]=4 134 B10R1.15 CC(c1ccccc1)NN CUR-0013496 [1,1,0,0,0,0|1,0,1]=4 135 B10R1.15 CCC(c1ccccc1)Br CUR-0015038 [1,1,0,0,0,0|1,0,1]=4 136 B10R1.15 C\C(=N/O)\c1ccccc1 CUR-0014326 [1,1,0,0,0,0|0,1,1]=4 137 B10R1.18 c1ccc(cc1)CC(=O)Cl CUR-0102510 [1,1,0,0,0,0|0,1,1]=4 138 B10R1.18 c1ccc(cc1)CC(=O)N CUR-0023680 [1,1,0,0,0,0|0,1,1]=4 139 B10R1.18 c1ccc(cc1)NC(=S)N CUR-0002897 [1,1,0,0,0,0|0,0,2]=4 140 B12R1.71 COc1ccc(cc1)CN=C=S CUR-0103052 [0,2,0,0,0,0|0,0,0]=2 141 B12R1.8 c1ccc(cc1)CCCN=C=O CUR-0102634 [0,2,0,0,0,0|0,1,0]=3 142 B12R1.8 c1ccc(cc1)OCCN=C=O CUR-0098931 [0,2,0,0,0,0|0,1,0]=3 143 B10R2.6 c1ccc(cc1)C2CO2 CUR-0008367 [1,0,0,1,0,0|0,1,1]=4 144 B10R2.7 c1ccc2c(c1)CC=C2 CUR-0101760 [1,0,0,1,0,0|1,0,1]=4 145 B10R2.7 c1ccc2c(c1)CCN2 CUR-0004344 [1,0,0,1,0,0|1,0,1]=4 146 B10R2.7 c1ccc2c(c1)CCO2 CUR-0101799 [1,0,0,1,0,0|0,1,1]=4 147 B10R2.7 c1ccc2c(c1)CNC2 CUR-0102527 [1,0,0,1,0,0|0,0,2]=4 148 B10R2.7 c1ccc2c(c1)[nH]cn2 CUR-0001355 [1,0,0,1,0,0|1,0,1]=4 149 B10R2.7 c1ccc2c(c1)[nH]cn2 CUR-0100600 [1,0,0,1,0,0|1,0,1]=4 150 B10R2.7 c1ccc2c(c1)[nH]nn2 CUR-0006438 [1,0,0,1,0,0|2,0,0]=4 151 B10R2.7 c1ccc2c(c1)cns2 CUR-0101309 [1,0,0,1,0,0|0,0,2]=4 152 B10R2.7 c1ccc2c(c1)ncs2 CUR-0016195 [1,0,0,1,0,0|0,0,2]=4 153 B10R2.320 c1ccc2c(c1)CC2N CUR-0083462 [1,0,0,1,0,0|1,0,1]=4 154 B8R1.8 c1cc(sc1)N=C=O CUR-0030121 [1,0,0,0,1,0|1,1,0]=4