0 B11R1.40 CC(=Cc1ccccc1)C=O CUR-0102280 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.40 CNC(=S)Nc1ccccc1 CUR-0079179 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.40 c1ccc(cc1)CC(=O)CO CUR-0026508 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.40 c1ccc(cc1)CC(C#N)N CUR-0100492 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.40 c1ccc(cc1)C\C(=N\O)\N CUR-0097985 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.40 c1ccc(cc1)NC(=S)NN CUR-0022762 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.17 CCNCc1ccccc1 CUR-0102061 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.17 c1ccc(cc1)CCC#N CUR-0101979 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.17 c1ccc(cc1)CCC=O CUR-0008089 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.17 c1ccc(cc1)CCCBr CUR-0021887 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.17 c1ccc(cc1)CCCN CUR-0102060 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.17 c1ccc(cc1)CCNN CUR-0021770 [1,0,0,0,0,0|1,0,0]=2 12 B10R1.17 c1ccc(cc1)CN=C=O CUR-0102011 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.17 c1ccc(cc1)CN=C=S CUR-0102333 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] CUR-0100840 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.17 c1ccc(cc1)COCCl CUR-0026033 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.17 c1ccc(cc1)NCCO CUR-0102101 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.17 c1ccc(cc1)OCCBr CUR-0014829 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.17 c1ccc(cc1)OCCN CUR-0096957 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.17 c1ccc(cc1)OCCO CUR-0100864 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.18 CC(=O)Cc1ccccn1 CUR-0031559 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.18 CC(=O)Cc1ccncc1 CUR-0102053 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.18 CC(=O)Nc1ccccc1 CUR-0023816 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.18 CC(Cc1ccccn1)N CUR-0068639 [1,0,0,0,0,0|1,0,0]=2 24 B10R1.18 c1ccc(cc1)CC(=O)Cl CUR-0102510 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.18 c1ccc(cc1)CC(=O)N CUR-0023680 [1,0,0,0,0,0|1,0,1]=3 26 B10R1.18 c1ccc(cc1)NC(=N)N CUR-0098795 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.18 c1ccc(cc1)NC(=S)N CUR-0002897 [1,0,0,0,0,0|2,0,1]=4 28 B12R1.32 CCOC(=O)Cc1ccccc1 CUR-0102728 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.34 CNC(=O)C(c1ccccc1)Cl CUR-0075715 [0,1,0,0,0,0|1,0,1]=3 30 B12R1.34 COC(=O)C(c1ccccc1)N CUR-0011708 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.43 CC(C(=O)O)Oc1ccccc1 CUR-0102771 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.43 c1ccc(cc1)CC(C(=O)O)N CUR-0015960 [0,1,0,0,0,0|3,0,0]=4 33 B12R1.43 c1ccc(cc1)CC(C(=O)O)O CUR-0034902 [0,1,0,0,0,0|3,0,0]=4 34 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N CUR-0102745 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.194 CC(C)(C#N)Nc1ccccc1 CUR-0095877 [0,1,0,0,0,0|3,0,0]=4 36 B12R2.18 Cc1[n+](c2ccccc2s1)C CUR-0100063 [0,0,0,1,0,0|1,0,2]=4 37 B12R2.18 Cc1c([nH]c2c1cccc2)C CUR-0102255 [0,0,0,1,0,0|2,0,1]=4 38 B12R2.18 Cc1nc2ccccc2n1C CUR-0101100 [0,0,0,1,0,0|1,0,1]=3 39 B12R2.18 Cn1c2ccccc2nc1Cl CUR-0099879 [0,0,0,1,0,0|2,0,1]=4 40 B12R2.18 Cn1c2ccccc2sc1=N CUR-0098047 [0,0,0,1,0,0|2,0,1]=4 41 B12R2.18 c1ccc2c(c1)C[C@H]([C@H]2N)O CUR-0102332 [0,0,0,1,0,0|3,0,0]=4 42 B12R2.24 CC1COc2ccccc2N1 CUR-0019482 [0,0,0,1,0,0|3,0,0]=4 43 B12R2.24 c1ccc2c(c1)CC(=O)NC2 CUR-0120672 [0,0,0,1,0,0|1,0,1]=3 44 B12R2.27 c1ccc(cc1)C2CC2C=O CUR-0009693 [0,0,0,1,0,0|2,0,0]=3 45 B12R2.27 c1ccc(cc1)C2CC2CN CUR-0093862 [0,0,0,1,0,0|2,0,0]=3 46 B12R2.2058 c1ccc(cc1)OC2CNC2 CUR-0092561 [0,0,0,1,0,0|3,0,0]=4 47 B10R1.15 CC(C=O)c1ccccc1 CUR-0102035 [0,0,0,0,1,0|2,0,0]=3 48 B10R1.15 CC(c1ccccc1)NN CUR-0013496 [0,0,0,0,1,0|1,0,0]=2 49 B10R1.15 CC(c1ccccn1)NC CUR-0022635 [0,0,0,0,1,0|1,0,0]=2 50 B10R1.15 CC(c1ccncc1)NC CUR-0021984 [0,0,0,0,1,0|1,0,0]=2 51 B10R1.15 CCC(=O)c1ccccc1 CUR-0024986 [0,0,0,0,1,0|2,0,1]=4 52 B10R1.15 CCC(c1ccccc1)Br CUR-0015038 [0,0,0,0,1,0|2,0,0]=3 53 B10R1.15 CN(C=O)c1ccccc1 CUR-0102052 [0,0,0,0,1,0|3,0,0]=4 54 B10R1.15 COC(=O)c1ccccc1 CUR-0016353 [0,0,0,0,1,0|2,0,1]=4 55 B10R1.15 C\C(=N/O)\c1ccccc1 CUR-0014326 [0,0,0,0,1,0|1,0,2]=4 56 B10R1.15 c1ccc(cc1)C(=O)NN CUR-0010769 [0,0,0,0,1,0|2,0,1]=4 57 B12R1.27 C#CC(CCc1ccccc1)O CUR-0049042 [0,0,0,0,0,1|2,0,1]=4 58 B12R1.27 c1ccc(cc1)OCC(=O)NN CUR-0037772 [0,0,0,0,0,1|2,0,1]=4 59 B9R1.8 CCNc1ccccc1 CUR-0000606 [2,0,0,0,0,0|1,0,0]=3 60 B9R1.8 CCOc1ccccc1 CUR-0022022 [2,0,0,0,0,0|1,0,0]=3 61 B9R1.8 CCSc1ccccc1 CUR-0102116 [2,0,0,0,0,0|1,0,0]=3 62 B9R1.8 CNCc1ccccc1 CUR-0014590 [2,0,0,0,0,0|0,0,0]=2 63 B9R1.8 CNCc1cccnc1 CUR-0029160 [2,0,0,0,0,0|1,0,0]=3 64 B9R1.8 CNCc1ccncc1 CUR-0029135 [2,0,0,0,0,0|1,0,0]=3 65 B9R1.8 CNCc1cnccn1 CUR-0014979 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.8 c1ccc(cc1)CC#N CUR-0026888 [2,0,0,0,0,0|0,0,2]=4 67 B9R1.8 c1ccc(cc1)CC=O CUR-0101800 [2,0,0,0,0,0|1,0,1]=4 68 B9R1.8 c1ccc(cc1)CCBr CUR-0103169 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.8 c1ccc(cc1)CCCl CUR-0006599 [2,0,0,0,0,0|1,0,0]=3 70 B9R1.8 c1ccc(cc1)CCN CUR-0101814 [2,0,0,0,0,0|0,0,0]=2 71 B9R1.8 c1ccc(cc1)CCO CUR-0012636 [2,0,0,0,0,0|1,0,0]=3 72 B9R1.8 c1ccc(cc1)CNN CUR-0008775 [2,0,0,0,0,0|1,0,0]=3 73 B9R1.8 c1ccc(cc1)CON CUR-0102606 [2,0,0,0,0,0|1,0,0]=3 74 B9R1.8 c1ccnc(c1)CNN CUR-0004430 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.8 c1cnccc1CCN CUR-0097215 [2,0,0,0,0,0|1,0,0]=3 76 B9R1.8 c1cnccc1CNN CUR-0019570 [2,0,0,0,0,0|2,0,0]=4 77 B11R1.1 CCCCc1ccc(cc1)N CUR-0102339 [1,1,0,0,0,0|1,0,0]=3 78 B11R1.1 CCCNc1ccc(cc1)Br CUR-0155140 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.1 CCCOc1ccc(cc1)Br CUR-0103649 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.1 CCCOc1ccc(cc1)O CUR-0102438 [1,1,0,0,0,0|2,0,0]=4 81 B11R1.16 CC(CC=O)c1ccccc1 CUR-0102318 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.16 CCCC(=O)c1ccccc1 CUR-0102314 [1,1,0,0,0,0|1,0,1]=4 83 B11R1.16 CNCC(c1ccccn1)O CUR-0014656 [1,1,0,0,0,0|1,0,0]=3 84 B11R1.17 COCOc1ccccc1N CUR-0050205 [1,1,0,0,0,0|2,0,0]=4 85 B11R1.24 CCNCc1cccc(c1)O CUR-0099154 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.24 Cc1cccc(c1)CCNC CUR-0071586 [1,1,0,0,0,0|0,0,0]=2 87 B11R1.28 CCCCNc1ccccc1 CUR-0102338 [1,1,0,0,0,0|1,0,0]=3 88 B11R1.28 CNCCCc1ccccc1 CUR-0099115 [1,1,0,0,0,0|0,0,0]=2 89 B11R1.28 c1ccc(cc1)CCN=C=O CUR-0102299 [1,1,0,0,0,0|0,0,2]=4 90 B11R1.28 c1ccc(cc1)CNCCO CUR-0002096 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.28 c1ccc(cc1)COCCN CUR-0029134 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.28 c1ccc(cc1)COCCO CUR-0102437 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.28 c1ccc(cc1)NCCC#N CUR-0102285 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.28 c1ccc(cc1)NCCCN CUR-0028802 [1,1,0,0,0,0|2,0,0]=4 95 B11R1.28 c1ccc(cc1)OCCCBr CUR-0026681 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.28 c1ccc(cc1)OCCNN CUR-0099002 [1,1,0,0,0,0|1,0,0]=3 97 B11R1.91 CC(=O)CCc1ccccc1 CUR-0102315 [1,1,0,0,0,0|1,0,0]=3 98 B11R1.91 CC(C)NCc1ccccc1 CUR-0102340 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.91 CC(CCc1ccccc1)Br CUR-0007729 [1,1,0,0,0,0|1,0,0]=3 100 B11R1.91 CC(CCc1ccccc1)N CUR-0102337 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.91 c1ccc(cc1)CCC(=N)N CUR-0100997 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.91 c1ccc(cc1)CCC(=O)O CUR-0101118 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.20 c1cc(ccc1CC(=N)N)Br CUR-0100937 [1,1,0,0,0,0|1,0,1]=4 104 B11R1.20 c1cc(ccc1CC(=N)N)F CUR-0101003 [1,1,0,0,0,0|1,0,1]=4 105 B11R1.36 CC(=O)C(c1ccccc1)Br CUR-0122545 [1,1,0,0,0,0|1,0,1]=4 106 B11R1.36 CC(C)C(=O)c1ccncc1 CUR-0013855 [1,1,0,0,0,0|1,0,1]=4 107 B11R1.36 CC(C)C(c1ccncc1)O CUR-0045942 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.36 c1ccc(cc1)C(C(=O)N)Cl CUR-0017900 [1,1,0,0,0,0|1,0,1]=4 109 B11R1.86 CC(=O)Cc1ccccc1O CUR-0016780 [1,1,0,0,0,0|1,0,1]=4 110 B11R1.86 CC(C)Oc1cccnc1Cl CUR-0071674 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.86 CC(Cc1ccccc1O)N CUR-0029823 [1,1,0,0,0,0|0,0,0]=2 112 B11R1.509 C[N+](C)(C)Cc1ccccc1 CUR-0001133 [1,1,0,0,0,0|1,0,0]=3 113 B11R1.509 C[N+](C)(C)Cc1ccccc1 CUR-0011358 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.7 CC(CN)(c1ccccc1)O CUR-0099481 [0,1,0,0,1,0|2,0,0]=4 115 B11R1.7 CN=S(=O)(C)c1ccccc1 CUR-0099971 [0,1,0,0,1,0|1,0,1]=4 116 B11R1.12 CCN(CC)c1ccccc1 CUR-0014750 [0,1,0,0,1,0|2,0,0]=4 117 B11R1.12 CCN(CC)c1ccccc1 CUR-0101238 [0,1,0,0,1,0|2,0,0]=4 118 B11R1.22 CC(c1ccc(cc1)Br)NN CUR-0021938 [0,1,0,0,1,0|1,0,0]=3 119 B11R1.22 CC(c1ccc(cc1)Cl)NN CUR-0012401 [0,1,0,0,1,0|1,0,0]=3 120 B13R1.254 CC(C)(CNc1ccccc1)CO CUR-0144611 [0,1,0,0,0,1|2,0,0]=4 121 B13R1.152 CN(C)C(=O)C(c1ccccc1)Cl CUR-0007108 [0,2,0,0,0,0|1,0,1]=4 122 B11R2.1 c1ccc2c(c1)CCC2=O CUR-0101990 [1,0,0,1,0,0|2,0,0]=4 123 B11R2.4 c1ccc(cc1)C2CC2N CUR-0089464 [1,0,0,1,0,0|2,0,0]=4 124 B11R2.20 c1c2c(ncn1)CCNC2 CUR-0099056 [1,0,0,1,0,0|2,0,0]=4 125 B11R2.20 c1c2c(ncn1)CCNC2 CUR-0100556 [1,0,0,1,0,0|2,0,0]=4 126 B11R2.20 c1cc2c(nc1)CCNC2 CUR-0006164 [1,0,0,1,0,0|1,0,0]=3 127 B11R2.20 c1ccc2c(c1)CCCC2 CUR-0012227 [1,0,0,1,0,0|1,0,0]=3 128 B11R2.20 c1ccc2c(c1)CCCN2 CUR-0021872 [1,0,0,1,0,0|2,0,0]=4 129 B11R2.20 c1ccc2c(c1)CCNC2 CUR-0010961 [1,0,0,1,0,0|0,0,0]=2 130 B11R2.10 CC1Cc2ccccc2N1 CUR-0102021 [1,0,0,1,0,0|0,0,0]=2 131 B11R2.10 Cc1[nH]c2ccccc2n1 CUR-0005431 [1,0,0,1,0,0|1,0,1]=4 132 B11R2.10 Cc1cc2ccccc2[nH]1 CUR-0101978 [1,0,0,1,0,0|0,0,2]=4 133 B11R2.10 c1ccc2c(c1)CC(=O)C2 CUR-0101992 [1,0,0,1,0,0|1,0,1]=4 134 B11R2.10 c1ccc2c(c1)CC(=O)N2 CUR-0102010 [1,0,0,1,0,0|1,0,1]=4 135 B11R2.10 c1ccc2c(c1)CC(C2)N CUR-0102844 [1,0,0,1,0,0|0,0,0]=2 136 B11R2.40 c1ccc(cc1)C2(CC2)N CUR-0100626 [0,0,0,1,1,0|2,0,0]=4 137 B13R2.10 c1ccc(cc1)C2CC(=O)NC2 CUR-0098359 [0,0,0,1,0,1|1,0,1]=4 138 B13R2.57 c1ccc2c(c1)CC(OC2)CO CUR-0098616 [0,0,0,1,0,1|2,0,0]=4 139 B13R2.15 c1ccc(cc1)[C@@H]2CCC[C@H]2N CUR-0154935 [0,1,0,1,0,0|2,0,0]=4 140 B13R2.31 c1ccc(cc1)CN2CC(C2)O CUR-0028427 [0,1,0,1,0,0|2,0,0]=4 141 B13R2.64 c1cc(cnc1)CC2CCNC2 CUR-0144155 [0,1,0,1,0,0|1,0,0]=3 142 B13R2.64 c1ccc(cc1)CC2CCNC2 CUR-0002701 [0,1,0,1,0,0|0,0,0]=2 143 B13R2.45 Cn1c2ccccc2nc1CN CUR-0100631 [0,1,0,1,0,0|1,0,1]=4 144 B13R2.45 Cn1c2ccccc2nc1CO CUR-0095833 [0,1,0,1,0,0|1,0,1]=4 145 B13R2.369 c1ccc2c(c1)CC(C(C2)O)N CUR-0096548 [0,1,0,1,0,0|2,0,0]=4 146 B13R2.423 c1ccc(cc1)C2CC2C(=O)O CUR-0154924 [0,1,0,1,0,0|2,0,0]=4 147 B13R2.5190 CN1c2ccc(cc2CC1=O)N CUR-0089230 [0,1,0,1,0,0|1,0,1]=4 148 B9R1.6 CC(=C)c1ccccc1 CUR-0101783 [1,0,0,0,1,0|0,0,2]=4 149 B9R1.6 CC(=O)c1ccccc1 CUR-0002350 [1,0,0,0,1,0|1,0,1]=4 150 B9R1.6 CC(c1ccccc1)Br CUR-0009957 [1,0,0,0,1,0|1,0,0]=3 151 B9R1.6 CC(c1ccccc1)N CUR-0006791 [1,0,0,0,1,0|0,0,0]=2 152 B9R1.6 CC(c1ccccn1)N CUR-0097687 [1,0,0,0,1,0|1,0,0]=3 153 B9R1.6 CC(c1cccnc1)Cl CUR-0095151 [1,0,0,0,1,0|2,0,0]=4 154 B9R1.6 CC(c1ccncc1)Cl CUR-0026970 [1,0,0,0,1,0|2,0,0]=4 155 B9R1.6 CN(C)c1ccccc1 CUR-0003058 [1,0,0,0,1,0|1,0,0]=3 156 B9R1.6 CN(C)c1ccncc1 CUR-0012964 [1,0,0,0,1,0|2,0,0]=4 157 B9R1.6 C[C@@H](c1ccccc1)N CUR-0100794 [1,0,0,0,1,0|0,0,0]=2 158 B9R1.6 C[C@H](c1ccccc1)N CUR-0019064 [1,0,0,0,1,0|0,0,0]=2 159 B9R1.6 c1ccc(cc1)C(=N)N CUR-0101311 [1,0,0,0,1,0|1,0,1]=4 160 B9R1.6 c1ccc(cc1)C(=N)N CUR-0101314 [1,0,0,0,1,0|1,0,1]=4 161 B9R1.6 c1ccc(cc1)C(=O)N CUR-0000442 [1,0,0,0,1,0|1,0,1]=4 162 B9R1.6 c1ccc(cc1)C(=S)N CUR-0011425 [1,0,0,0,1,0|1,0,1]=4 163 B9R1.11 CC(c1cccs1)NC CUR-0011737 [0,0,0,0,2,0|1,0,0]=3