0 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl A2Z00041387 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.891 c1ccc(cc1)CCS(=O)(=O)O A2Z00009461 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.91 CC(C)NCc1ccccc1 A2Z00093460 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.91 c1ccc(cc1)NCC(=O)O A2Z00087068 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.91 c1ccnc(c1)CCC(=O)O A2Z00094491 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.838 CC(C)(CCc1cccc(c1)Cl)N A2Z00049406 [0,1,0,0,0,0|1,0,0]=2 6 B13R1.838 CC(C)(CCc1cccc(c1)Cl)O A2Z00094727 [0,1,0,0,0,0|0,0,0]=1 7 B13R2.222 CC1(CNc2ccccc2N1)C A2Z00070097 [0,0,0,1,0,0|2,0,0]=3 8 B13R2.222 CC1(CNc2ccccc2O1)C A2Z00070520 [0,0,0,1,0,0|1,0,0]=2 9 B13R1.3523 CC(C)(COCc1ccccc1)N A2Z00070300 [0,0,0,0,0,1|1,0,0]=2 10 B10R1.17 CCNCc1ccccc1 A2Z00093459 [2,0,0,0,0,0|1,0,0]=3 11 B10R1.17 CNCCc1ccncc1 A2Z00061328 [2,0,0,0,0,0|2,0,0]=4 12 B10R1.17 c1cc(cnc1)CCCN A2Z00046192 [2,0,0,0,0,0|2,0,0]=4 13 B10R1.17 c1ccc(cc1)CCNN A2Z00095988 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.17 c1ccc(cc1)CCNN A2Z00096724 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.17 c1ccc(cc1)OCCO A2Z00038602 [2,0,0,0,0,0|1,0,0]=3 16 B10R1.17 c1ccc(cc1)OCCS A2Z00049974 [2,0,0,0,0,0|1,1,0]=4 17 B12R1.21 CC(=O)CCc1ccc(cc1)Br A2Z00049942 [1,1,0,0,0,0|0,0,2]=4 18 B12R1.21 CC(CCc1ccc(cc1)Br)N A2Z00049943 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.21 CC(COc1ccc(cc1)Cl)N A2Z00073642 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.21 Cc1ccc(cc1)CCC(=O)O A2Z00082764 [1,1,0,0,0,0|1,0,1]=4 21 B12R1.21 c1cc(ccc1CCC(=O)O)Cl A2Z00038303 [1,1,0,0,0,0|1,0,1]=4 22 B12R1.21 c1cc(ccc1CCC(=O)O)F A2Z00039157 [1,1,0,0,0,0|1,0,1]=4 23 B12R1.21 c1cc(ccc1CCC(=O)O)O A2Z00096742 [1,1,0,0,0,0|1,0,1]=4 24 B12R1.27 c1ccc(cc1)CCC(=O)CBr A2Z00094984 [1,1,0,0,0,0|0,0,2]=4 25 B12R1.43 CC(C)C(Cc1ccccc1)O A2Z00048082 [1,1,0,0,0,0|0,0,0]=2 26 B12R1.43 CC(Cc1ccccc1)C(=O)O A2Z00046441 [1,1,0,0,0,0|1,0,1]=4 27 B12R1.107 CC(C)CC(c1ccccc1)O A2Z00048081 [1,1,0,0,0,0|0,0,0]=2 28 B12R1.107 CC(CC(=O)O)c1ccccc1 A2Z00094013 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.107 CN(C)CC(=O)c1ccccc1 A2Z00074274 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl A2Z00095189 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.125 c1ccc(c(c1)CCC(=O)O)F A2Z00039158 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.226 CC(=O)CCc1cccc(c1)Cl A2Z00094749 [1,1,0,0,0,0|0,0,2]=4 33 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O A2Z00095187 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.226 c1cc(cc(c1)F)CCC(=O)O A2Z00094264 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.106 CC(C)(C)Oc1ccc(cc1)N A2Z00062443 [0,1,0,0,1,0|2,0,0]=4 36 B12R1.106 Cc1ccc(cc1)CC(C)(C)N A2Z00046253 [0,1,0,0,1,0|1,0,0]=3 37 B12R1.194 CC(C)(C#N)Nc1ccccc1 A2Z00016789 [0,1,0,0,1,0|2,0,0]=4 38 B12R1.194 CC(C)(Cc1ccccc1)C#N A2Z00070041 [0,1,0,0,1,0|1,0,0]=3 39 B14R1.293 CC(CCc1ccc(cc1)Br)(C#N)N A2Z00095030 [0,2,0,0,0,0|1,0,1]=4 40 B12R2.24 CC1CNc2ccccc2O1 A2Z00070209 [1,0,0,1,0,0|1,0,0]=3 41 B12R2.24 CC1Cc2ccccc2NC1 A2Z00046499 [1,0,0,1,0,0|1,0,0]=3 42 B12R2.2403 CC1(CNc2c1cccc2)C A2Z00049178 [1,0,0,1,0,0|1,0,0]=3 43 B14R2.2973 CC1(COc2ccccc2O1)CN A2Z00098477 [0,1,0,1,0,0|1,0,0]=3 44 B14R2.2973 CC1(COc2ccccc2O1)CO A2Z00073895 [0,1,0,1,0,0|1,0,0]=3 45 B14R2.639 CC1(C(=O)Nc2ccccc2O1)C A2Z00069807 [0,1,0,1,0,0|1,0,1]=4 46 B10R1.66 CC(C)NCc1ccco1 A2Z00087006 [1,0,0,0,1,0|2,0,0]=4 47 B10R1.28 CC(C)(c1ccncc1)O A2Z00094997 [0,0,0,0,2,0|1,0,0]=3 48 B12R1.252 c1ccc(cc1)CNCC(=O)O A2Z00095934 [1,0,0,0,0,1|1,0,1]=4 49 B12R1.252 c1ccc(cc1)NCCC(=O)O A2Z00094158 [1,0,0,0,0,1|1,0,1]=4 50 B12R1.252 c1ccc(cc1)OCCC(=O)O A2Z00077109 [1,0,0,0,0,1|1,0,1]=4 51 B12R1.252 c1ccc(cc1)SCCC(=O)O A2Z00085612 [1,0,0,0,0,1|1,0,1]=4