0 B12R1.891 CC(C)(C)CNc1ccccc1 CUR-0100009 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl CUR-0100546 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.891 c1ccc(cc1)NCC(F)(F)F CUR-0099951 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.91 CC(=O)CCc1ccccc1 CUR-0102315 [1,0,0,0,0,0|0,0,2]=3 4 B11R1.91 CC(C)NCc1ccccc1 CUR-0102340 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.91 CC(CCc1ccccc1)Br CUR-0007729 [1,0,0,0,0,0|1,0,0]=2 6 B11R1.91 CC(CCc1ccccc1)N CUR-0102337 [1,0,0,0,0,0|1,0,0]=2 7 B11R1.91 c1ccc(cc1)CCC(=N)N CUR-0100997 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.91 c1ccc(cc1)CCC(=O)O CUR-0101118 [1,0,0,0,0,0|1,0,1]=3 9 B11R1.91 c1ccc(cc1)OCC(=O)O CUR-0101088 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.91 c1ccc(cc1)SCC(=O)O CUR-0095901 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.91 c1ccnc(c1)CCC(=O)O CUR-0008516 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.254 CC(C)(CNc1ccccc1)CO CUR-0144611 [0,1,0,0,0,0|1,0,0]=2 13 B11R1.509 C[N+](C)(C)Cc1ccccc1 CUR-0001133 [0,0,0,0,1,0|2,0,0]=3 14 B11R1.509 C[N+](C)(C)Cc1ccccc1 CUR-0011358 [0,0,0,0,1,0|2,0,0]=3 15 B10R1.17 CCNCc1ccccc1 CUR-0102061 [2,0,0,0,0,0|1,0,0]=3 16 B10R1.17 c1ccc(cc1)CCC#N CUR-0101979 [2,0,0,0,0,0|1,0,1]=4 17 B10R1.17 c1ccc(cc1)CCC=O CUR-0008089 [2,0,0,0,0,0|0,0,2]=4 18 B10R1.17 c1ccc(cc1)CCCBr CUR-0021887 [2,0,0,0,0,0|1,0,0]=3 19 B10R1.17 c1ccc(cc1)CCCN CUR-0102060 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.17 c1ccc(cc1)CCNN CUR-0021770 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.17 c1ccc(cc1)COCCl CUR-0026033 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.17 c1ccc(cc1)NCCO CUR-0102101 [2,0,0,0,0,0|1,0,0]=3 23 B10R1.17 c1ccc(cc1)OCCBr CUR-0014829 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.17 c1ccc(cc1)OCCN CUR-0096957 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.17 c1ccc(cc1)OCCO CUR-0100864 [2,0,0,0,0,0|1,0,0]=3 26 B12R1.21 CN(C)CCc1ccc(cc1)N CUR-0099469 [1,1,0,0,0,0|1,0,0]=3 27 B12R1.21 c1cc(ccc1CCC(=O)O)Br CUR-0119507 [1,1,0,0,0,0|1,0,1]=4 28 B12R1.21 c1cc(ccc1CCC(=O)O)F CUR-0100368 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.21 c1cc(ccc1CCC(=O)O)N CUR-0068808 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.21 c1cc(ccc1CCC(=O)O)O CUR-0102779 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.27 C#CC(CCc1ccccc1)O CUR-0049042 [1,1,0,0,0,0|0,0,1]=3 32 B12R1.43 c1ccc(cc1)CC(C(=O)O)N CUR-0015960 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.43 c1ccc(cc1)CC(C(=O)O)O CUR-0034902 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N CUR-0102745 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.107 CC(CC(=O)O)c1ccccc1 CUR-0102721 [1,1,0,0,0,0|1,0,1]=4 36 B12R1.107 C[C@@H](c1ccccc1)NC(C)C CUR-0045830 [1,1,0,0,0,0|1,0,0]=3 37 B12R1.107 C[C@H](c1ccccc1)NC(C)C CUR-0045829 [1,1,0,0,0,0|1,0,0]=3 38 B12R1.125 CC(C)CNc1ccccc1N CUR-0062360 [1,1,0,0,0,0|1,0,0]=3 39 B12R1.125 Cc1ccccc1CCC(=O)O CUR-0100370 [1,1,0,0,0,0|1,0,1]=4 40 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br CUR-0100358 [1,1,0,0,0,0|1,0,1]=4 41 B12R1.125 c1ccc(c(c1)CCC(=O)O)F CUR-0100367 [1,1,0,0,0,0|1,0,1]=4 42 B12R1.226 Cc1cccc(c1)CCC(=O)O CUR-0100371 [1,1,0,0,0,0|1,0,1]=4 43 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O CUR-0100361 [1,1,0,0,0,0|1,0,1]=4 44 B12R1.226 c1cc(cc(c1)O)CCC(=O)O CUR-0029909 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.194 CC(C)(C#N)Nc1ccccc1 CUR-0095877 [0,1,0,0,1,0|2,0,0]=4 46 B14R1.3099 CC(C)(C)C(=O)CCc1ccccc1 CUR-0100005 [0,1,0,0,0,1|1,0,0]=3 47 B14R1.290 CC(C)(CN(c1ccccc1)N)CO CUR-0153516 [0,2,0,0,0,0|1,0,0]=3 48 B12R2.24 CC1COc2ccccc2N1 CUR-0019482 [1,0,0,1,0,0|2,0,0]=4 49 B12R2.2057 c1ccc(cc1)OCC2CO2 CUR-0002727 [1,0,0,1,0,0|1,0,0]=3 50 B14R2.2973 c1ccc2c(c1)CCC(C2)(CN)O CUR-0099493 [0,1,0,1,0,0|0,0,0]=2 51 B14R2.29496 CC1(CC(=O)c2ccccc2O1)C CUR-0020463 [0,1,0,1,0,0|0,0,1]=3 52 B14R2.639 CC1(C(=O)Oc2ccccc2O1)C CUR-0004385 [0,1,0,1,0,0|1,0,1]=4 53 B10R1.18 CC(Cc1ccccn1)N CUR-0068639 [1,0,0,0,1,0|2,0,0]=4 54 B10R1.28 CC(C)(C)c1ccccc1 CUR-0102040 [0,0,0,0,2,0|1,0,0]=3 55 B12R1.252 c1ccc(cc1)CCCC(=O)O CUR-0102723 [1,0,0,0,0,1|1,0,1]=4 56 B12R1.252 c1ccc(cc1)CNCC(=O)O CUR-0102750 [1,0,0,0,0,1|1,0,1]=4 57 B12R1.252 c1ccc(cc1)CSCC(=O)O CUR-0103124 [1,0,0,0,0,1|1,0,1]=4 58 B12R1.252 c1ccc(cc1)SCCC(=O)O CUR-0095899 [1,0,0,0,0,1|1,0,1]=4