0 B7R0.1 CCCCCCC=O CUR-0101726 [1,0,0,0,0,0|0,0,3]=4 1 B9R1.5 c1ccc(c(=O)cc1)O CUR-0101821 [0,0,0,1,0,0|1,0,2]=4 2 B9R1.8 CCNc1ccccc1 CUR-0000606 [0,0,0,1,0,0|2,0,0]=3 3 B9R1.8 CCOc1ccccc1 CUR-0022022 [0,0,0,1,0,0|2,0,0]=3 4 B9R1.8 CCSc1ccccc1 CUR-0102116 [0,0,0,1,0,0|2,0,0]=3 5 B9R1.8 CNCc1ccccc1 CUR-0014590 [0,0,0,1,0,0|2,0,0]=3 6 B9R1.8 CNCc1cccnc1 CUR-0029160 [0,0,0,1,0,0|3,0,0]=4 7 B9R1.8 CNCc1ccncc1 CUR-0029135 [0,0,0,1,0,0|3,0,0]=4 8 B9R1.8 CNCc1cnccn1 CUR-0014979 [0,0,0,1,0,0|3,0,0]=4 9 B9R1.8 c1ccc(cc1)CC#N CUR-0026888 [0,0,0,1,0,0|2,0,1]=4 10 B9R1.8 c1ccc(cc1)CC=O CUR-0101800 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.8 c1ccc(cc1)CCBr CUR-0103169 [0,0,0,1,0,0|2,0,0]=3 12 B9R1.8 c1ccc(cc1)CCCl CUR-0006599 [0,0,0,1,0,0|2,0,0]=3 13 B9R1.8 c1ccc(cc1)CCN CUR-0101814 [0,0,0,1,0,0|2,0,0]=3 14 B9R1.8 c1ccc(cc1)CCO CUR-0012636 [0,0,0,1,0,0|2,0,0]=3 15 B9R1.8 c1ccc(cc1)CNN CUR-0008775 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.8 c1ccc(cc1)CON CUR-0102606 [0,0,0,1,0,0|3,0,0]=4 17 B9R1.8 c1ccnc(c1)CC#N CUR-0100818 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.8 c1ccnc(c1)CNN CUR-0004430 [0,0,0,1,0,0|3,0,0]=4 19 B9R1.8 c1cnccc1CCN CUR-0097215 [0,0,0,1,0,0|3,0,0]=4 20 B9R1.14 CCn1cccc1C=O CUR-0032264 [0,0,0,1,0,0|1,0,0]=2 21 B9R1.15 CCc1ccccc1N CUR-0101239 [0,0,0,1,0,0|1,0,1]=3 22 B9R1.15 COc1ccccc1Br CUR-0103202 [0,0,0,1,0,0|2,0,1]=4 23 B9R1.15 COc1ccccc1F CUR-0101889 [0,0,0,1,0,0|2,0,1]=4 24 B9R1.15 COc1ccccc1I CUR-0103823 [0,0,0,1,0,0|2,0,1]=4 25 B9R1.15 COc1ccccc1N CUR-0026684 [0,0,0,1,0,0|2,0,1]=4 26 B9R1.15 COc1ccccc1N CUR-0101258 [0,0,0,1,0,0|2,0,1]=4 27 B9R1.15 COc1ccccc1O CUR-0101859 [0,0,0,1,0,0|1,0,2]=4 28 B9R1.15 CSc1ccccc1N CUR-0102129 [0,0,0,1,0,0|2,0,1]=4 29 B9R1.15 Cc1ccccc1C=O CUR-0101798 [0,0,0,1,0,0|0,0,2]=3 30 B9R1.15 Cc1ccccc1CCl CUR-0000197 [0,0,0,1,0,0|2,0,1]=4 31 B9R1.15 Cc1ccccc1OC CUR-0101827 [0,0,0,1,0,0|2,0,1]=4 32 B9R1.15 c1ccc(c(c1)C=O)Br CUR-0103166 [0,0,0,1,0,0|1,0,2]=4 33 B9R1.15 c1ccc(c(c1)C=O)Cl CUR-0001218 [0,0,0,1,0,0|1,0,2]=4 34 B9R1.15 c1ccc(c(c1)C=O)F CUR-0009497 [0,0,0,1,0,0|1,0,2]=4 35 B9R1.15 c1ccc(c(c1)C=O)O CUR-0022364 [0,0,0,1,0,0|1,0,2]=4 36 B9R1.15 c1ccc(c(c1)CBr)Br CUR-0103922 [0,0,0,1,0,0|2,0,1]=4 37 B9R1.15 c1ccc(c(c1)CBr)F CUR-0103234 [0,0,0,1,0,0|2,0,1]=4 38 B9R1.15 c1ccc(c(c1)CCl)Cl CUR-0100771 [0,0,0,1,0,0|2,0,1]=4 39 B9R1.15 c1ccc(c(c1)CN)Cl CUR-0102172 [0,0,0,1,0,0|2,0,1]=4 40 B9R1.15 c1ccc(c(c1)CN)F CUR-0101874 [0,0,0,1,0,0|2,0,1]=4 41 B9R1.15 c1ccc(c(c1)CN)N CUR-0101838 [0,0,0,1,0,0|2,0,1]=4 42 B9R1.15 c1ccc(c(c1)CO)N CUR-0101848 [0,0,0,1,0,0|2,0,1]=4 43 B9R1.15 c1ccc(c(c1)CO)O CUR-0101860 [0,0,0,1,0,0|1,0,2]=4 44 B6R0.6 CCCCOC=C CUR-0002040 [2,0,0,0,0,0|1,0,1]=4 45 B8R1.2 C1CC(=COC1)C=O CUR-0100474 [1,0,0,1,0,0|1,0,0]=3 46 B8R1.2 C1CC(CC=C1)C=O CUR-0018878 [1,0,0,1,0,0|0,0,2]=4 47 B8R1.2 CCc1ccccc1 CUR-0101653 [1,0,0,1,0,0|0,0,1]=3 48 B8R1.2 CNc1ccccc1 CUR-0101656 [1,0,0,1,0,0|1,0,1]=4 49 B8R1.2 COc1ccccc1 CUR-0026843 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.2 CSc1ccccc1 CUR-0101870 [1,0,0,1,0,0|1,0,1]=4 51 B8R1.2 c1cc(cnc1)C=O CUR-0007220 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.2 c1ccc(cc1)C=O CUR-0027632 [1,0,0,1,0,0|0,0,2]=4 53 B8R1.2 c1ccc(cc1)CBr CUR-0024935 [1,0,0,1,0,0|1,0,1]=4 54 B8R1.2 c1ccc(cc1)CCl CUR-0014141 [1,0,0,1,0,0|1,0,1]=4 55 B8R1.2 c1ccc(cc1)CN CUR-0009810 [1,0,0,1,0,0|1,0,1]=4 56 B8R1.2 c1ccc(cc1)CN CUR-0101294 [1,0,0,1,0,0|1,0,1]=4 57 B8R1.2 c1ccc(cc1)CO CUR-0002024 [1,0,0,1,0,0|1,0,1]=4 58 B8R1.2 c1ccc(cc1)CS CUR-0005953 [1,0,0,1,0,0|1,0,1]=4 59 B8R1.2 c1ccnc(c1)C=O CUR-0011586 [1,0,0,1,0,0|1,0,1]=4 60 B8R1.2 c1ccnc(c1)CCl CUR-0006464 [1,0,0,1,0,0|2,0,0]=4 61 B8R1.2 c1ccnc(c1)CN CUR-0101659 [1,0,0,1,0,0|2,0,0]=4 62 B8R1.2 c1ccnc(c1)CO CUR-0101669 [1,0,0,1,0,0|2,0,0]=4 63 B8R1.5 Cc1cccc[n+]1C CUR-0000858 [1,0,0,1,0,0|2,0,0]=4 64 B8R1.5 Cc1ccccc1C CUR-0015131 [1,0,0,1,0,0|1,0,1]=4 65 B8R1.5 Cc1ccccc1Cl CUR-0010314 [1,0,0,1,0,0|1,0,1]=4 66 B8R1.5 Cc1ccccc1F CUR-0101680 [1,0,0,1,0,0|1,0,1]=4 67 B8R1.5 Cc1ccccc1N CUR-0016164 [1,0,0,1,0,0|1,0,1]=4 68 B8R1.5 Cc1ccccc1N CUR-0101242 [1,0,0,1,0,0|1,0,1]=4 69 B8R1.5 Cc1ccccc1O CUR-0027741 [1,0,0,1,0,0|0,0,2]=4 70 B8R1.8 CNCc1ccco1 CUR-0097176 [1,0,0,1,0,0|1,0,1]=4 71 B8R1.8 c1cc(sc1)CCCl CUR-0025864 [1,0,0,1,0,0|1,1,0]=4 72 B8R1.8 c1cc(sc1)CCN CUR-0024737 [1,0,0,1,0,0|1,1,0]=4 73 B8R1.8 c1cc(sc1)CCO CUR-0101927 [1,0,0,1,0,0|1,1,0]=4 74 B8R1.8 c1ccn(c1)CCN CUR-0098345 [1,0,0,1,0,0|2,0,0]=4 75 B8R1.8 c1ccn(c1)CCO CUR-0065799 [1,0,0,1,0,0|2,0,0]=4 76 B8R1.8 c1cocc1CCN CUR-0000916 [1,0,0,1,0,0|2,0,0]=4 77 B8R1.8 c1cscc1CCN CUR-0014064 [1,0,0,1,0,0|2,0,0]=4 78 B8R1.11 Cc1ccsc1C=O CUR-0101892 [1,0,0,1,0,0|1,0,1]=4 79 B8R1.11 Cn1cccc1C=O CUR-0101671 [1,0,0,1,0,0|1,0,0]=3 80 B8R1.11 Cn1ccnc1C=O CUR-0023364 [1,0,0,1,0,0|2,0,0]=4 81 B8R1.11 Cn1cncc1C=O CUR-0023370 [1,0,0,1,0,0|2,0,0]=4 82 B10R1.10 CCCc1cc(ncn1)Cl CUR-0013127 [0,1,0,1,0,0|2,0,0]=4 83 B10R1.10 CCNc1cccc(c1)C CUR-0102062 [0,1,0,1,0,0|2,0,0]=4 84 B10R1.10 CNCc1cccc(=O)[nH]1 CUR-0124316 [0,1,0,1,0,0|1,0,0]=3 85 B10R1.18 C1CCC(=CC1)CC(=O)O CUR-0015928 [0,1,0,1,0,0|0,0,2]=4 86 B10R1.18 CC(=O)Cc1ccccn1 CUR-0031559 [0,1,0,1,0,0|1,0,1]=4 87 B10R1.18 CC(Cc1ccccn1)N CUR-0068639 [0,1,0,1,0,0|1,0,0]=3 88 B10R1.39 CCc1ccsc1C(=O)O CUR-0016722 [0,1,0,1,0,0|1,0,1]=4 89 B10R1.39 CCn1c(ccn1)C(=O)Cl CUR-0098259 [0,1,0,1,0,0|2,0,0]=4 90 B10R1.61 CC(C)c1ccccc1N CUR-0102057 [0,1,0,1,0,0|1,0,1]=4 91 B10R1.61 CC(C)c1ccccc1O CUR-0102076 [0,1,0,1,0,0|0,0,2]=4 92 B10R1.61 CC(c1ccccc1F)Cl CUR-0010453 [0,1,0,1,0,0|1,0,1]=4 93 B10R1.61 Cc1ccccc1C(=O)C CUR-0102033 [0,1,0,1,0,0|0,0,2]=4 94 B10R1.61 Cc1ccccc1C(=O)O CUR-0016076 [0,1,0,1,0,0|0,0,2]=4 95 B10R1.11 CCOC(=O)c1ccco1 CUR-0102138 [0,1,0,1,0,0|1,0,1]=4 96 B10R1.25 Cc1ccc(c(n1)C)C=O CUR-0122211 [0,1,0,1,0,0|1,0,1]=4 97 B10R1.245 Cc1cccc(c1C=O)C CUR-0101350 [0,1,0,1,0,0|0,0,2]=4 98 B10R1.4 CCNc1ccccc1C CUR-0102055 [0,1,0,1,0,0|1,0,1]=4 99 B10R1.4 CCOc1ccccc1N CUR-0102094 [0,1,0,1,0,0|1,0,1]=4 100 B10R1.4 CCOc1cccnc1Cl CUR-0058309 [0,1,0,1,0,0|2,0,0]=4 101 B10R1.4 c1cc(=O)n(nc1)CCN CUR-0096955 [0,1,0,1,0,0|2,0,0]=4 102 B10R1.4 c1ccn(c(=O)c1)CCCl CUR-0101246 [0,1,0,1,0,0|1,0,0]=3 103 B10R1.4 c1ccn(c(=O)c1)CCO CUR-0011459 [0,1,0,1,0,0|1,0,0]=3 104 B10R1.4 c1cnc(=O)n(c1)CCN CUR-0144440 [0,1,0,1,0,0|2,0,0]=4 105 B10R1.17 CCNCc1ccccc1 CUR-0102061 [0,1,0,1,0,0|1,0,0]=3 106 B10R1.17 c1ccc(cc1)CCC#N CUR-0101979 [0,1,0,1,0,0|1,0,1]=4 107 B10R1.17 c1ccc(cc1)CCC=O CUR-0008089 [0,1,0,1,0,0|1,0,1]=4 108 B10R1.17 c1ccc(cc1)CCCBr CUR-0021887 [0,1,0,1,0,0|1,0,0]=3 109 B10R1.17 c1ccc(cc1)CCCN CUR-0102060 [0,1,0,1,0,0|1,0,0]=3 110 B10R1.17 c1ccc(cc1)CCNN CUR-0021770 [0,1,0,1,0,0|2,0,0]=4 111 B10R1.17 c1ccc(cc1)COCCl CUR-0026033 [0,1,0,1,0,0|2,0,0]=4 112 B10R1.17 c1ccc(cc1)NCCO CUR-0102101 [0,1,0,1,0,0|2,0,0]=4 113 B10R1.17 c1ccc(cc1)OCCBr CUR-0014829 [0,1,0,1,0,0|2,0,0]=4 114 B10R1.17 c1ccc(cc1)OCCN CUR-0096957 [0,1,0,1,0,0|2,0,0]=4 115 B10R1.17 c1ccc(cc1)OCCO CUR-0100864 [0,1,0,1,0,0|2,0,0]=4 116 B10R1.30 Cc1ccc(cc1C=O)Cl CUR-0098676 [0,1,0,1,0,0|0,0,2]=4 117 B10R1.5 C#CCn1cccc1C=O CUR-0144521 [0,1,0,1,0,0|0,0,2]=4 118 B10R1.5 CCCn1ccnc1C=O CUR-0039524 [0,1,0,1,0,0|1,0,0]=3 119 B10R1.20 COc1ccccc1C=O CUR-0101243 [0,1,0,1,0,0|0,0,2]=4 120 B10R1.1 CCOc1ccc(cc1)N CUR-0022033 [0,1,0,1,0,0|2,0,0]=4 121 B10R1.1 CCOc1ccc(cc1)N CUR-0101205 [0,1,0,1,0,0|2,0,0]=4 122 B10R1.1 CCOc1ccc(cc1)O CUR-0102108 [0,1,0,1,0,0|2,0,0]=4 123 B10R1.1 c1cc(ccc1CCBr)Br CUR-0048359 [0,1,0,1,0,0|2,0,0]=4 124 B10R1.1 c1cc(ccc1CCN)Cl CUR-0102529 [0,1,0,1,0,0|2,0,0]=4 125 B10R1.1 c1cc(ccc1CCN)F CUR-0102128 [0,1,0,1,0,0|2,0,0]=4 126 B10R1.1 c1cc(ccc1CCO)Br CUR-0103457 [0,1,0,1,0,0|2,0,0]=4 127 B10R1.1 c1cc(ccc1CCO)Cl CUR-0046489 [0,1,0,1,0,0|2,0,0]=4 128 B10R1.1 c1cc(ccc1CCO)F CUR-0102141 [0,1,0,1,0,0|2,0,0]=4 129 B10R1.1 c1cc(ccc1CCO)N CUR-0102103 [0,1,0,1,0,0|2,0,0]=4 130 B10R1.1 c1cc(ccc1CCO)O CUR-0102110 [0,1,0,1,0,0|2,0,0]=4 131 B10R1.15 CC(c1ccccn1)NC CUR-0022635 [0,1,0,1,0,0|2,0,0]=4 132 B10R1.15 CCC(=O)c1ccccc1 CUR-0024986 [0,1,0,1,0,0|1,0,1]=4 133 B10R1.15 CCC(c1ccccc1)Br CUR-0015038 [0,1,0,1,0,0|1,0,0]=3 134 B10R1.15 c1ccnc(c1)C(CN)O CUR-0023325 [0,1,0,1,0,0|2,0,0]=4 135 B10R1.172 COc1cccc(c1)C=O CUR-0014351 [0,1,0,1,0,0|1,0,1]=4 136 B10R2.6 c1ccc(cc1)C2CO2 CUR-0008367 [0,0,0,2,0,0|2,0,0]=4 137 B10R2.6 c1ccnc(c1)C2CO2 CUR-0029244 [0,0,0,2,0,0|2,0,0]=4 138 B10R2.7 c1cc2c(nc1)CCC2 CUR-0027301 [0,0,0,2,0,0|1,0,0]=3 139 B10R2.7 c1cc2c(nc1)CCN2 CUR-0020753 [0,0,0,2,0,0|2,0,0]=4 140 B10R2.7 c1cc2c(nc1)CNC2 CUR-0090690 [0,0,0,2,0,0|2,0,0]=4 141 B10R2.7 c1ccc2c(c1)CCN2 CUR-0004344 [0,0,0,2,0,0|1,0,1]=4 142 B10R2.7 c1ccc2c(c1)CCO2 CUR-0101799 [0,0,0,2,0,0|0,0,2]=4 143 B10R2.7 c1ccc2c(c1)CNC2 CUR-0102527 [0,0,0,2,0,0|2,0,0]=4 144 B10R2.320 c1ccc2c(c1)CC2N CUR-0083462 [0,0,0,2,0,0|2,0,0]=4