0 B10R1.4 CCOc1ccccc1Br T20308 [1,0,0,0,0,0|1,1,0]=3 1 B10R1.4 CSCc1ccccc1O T33357 [1,0,0,0,0,0|2,0,0]=3 2 B10R1.4 Oc1ccccc1CC=C T20472 [1,0,0,0,0,0|1,0,2]=4 3 B10R1.17 CCOCc1ccccc1 T36790 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.17 CNCCc1ccccn1 T0246 [1,0,0,0,0,0|1,0,0]=2 5 B10R1.17 CNCCc1ccccn1 T0246L [1,0,0,0,0,0|1,0,0]=2 6 B10R1.17 CNCCc1ccccn1 T4195 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.17 NNCCc1ccccc1 T12441 [1,0,0,0,0,0|1,0,0]=2 8 B10R1.17 NNCCc1ccccc1 T50010 [1,0,0,0,0,0|1,0,0]=2 9 B10R1.17 O=CCCc1ccccc1 T20312 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.17 OCCCc1ccccc1 T3754 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.17 OCCOc1ccccc1 T20293 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.17 S=C=NCc1ccccc1 T1082 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.69 CCCCc1ccc(C)cc1O T33233 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.69 CCCCc1ccc(O)cc1O T7125 [0,1,0,0,0,0|2,0,0]=3 15 B12R1.125 CC(N)CCc1ccccc1Cl T24797 [0,1,0,0,0,0|1,0,0]=2 16 B12R1.125 OC(=O)CCc1ccccc1O T4892 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.267 CCCCCc1ccccc1O T33809 [0,1,0,0,0,0|2,0,0]=3 18 B10R0.71 CCCCC/C=C/C=C/C=O T9506 [0,0,1,0,0,0|2,0,1]=4 19 B12R2.24 CC1CCc2ccccc2N1 T20448 [0,0,0,1,0,0|2,0,0]=3 20 B12R2.24 O=C1CCc2ccccc2C1 T0660 [0,0,0,1,0,0|3,0,0]=4 21 B12R2.24 O=C1CCc2ccccc2O1 T2S0300 [0,0,0,1,0,0|3,0,0]=4 22 B9R1.8 CCOc1ccccc1 T19753 [2,0,0,0,0,0|1,0,0]=3 23 B9R1.8 CNCc1ccccc1 T8016 [2,0,0,0,0,0|0,0,0]=2 24 B9R1.8 NCCc1ccccc1 T2935 [2,0,0,0,0,0|0,0,0]=2 25 B9R1.8 NCCc1ccccc1 T7433 [2,0,0,0,0,0|0,0,0]=2 26 B9R1.8 NCCc1ccccn1 T22501 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.8 O=CCc1ccccc1 TCS1857 [2,0,0,0,0,0|1,0,1]=4 28 B9R1.8 OCCc1ccccc1 T0011 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.8 OCCc1ccccn1 T0658 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.15 COc1ccccc1O T1301 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.15 NCc1ccccc1O T41358 [2,0,0,0,0,0|1,0,0]=3 32 B9R1.15 OCc1ccccc1O T0311 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.81 CCCc1ccc(C)cc1O T33238 [1,1,0,0,0,0|1,0,0]=3 34 B11R1.81 Clc1ccc(CC#N)c(Cl)c1 T20375 [1,1,0,0,0,0|0,0,2]=4 35 B11R1.222 CCC(=O)c1ccccc1O T20371 [1,1,0,0,0,0|1,0,1]=4 36 B11R1.1 CCOCc1ccc(O)cc1 TN3029 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.1 COCCc1ccc(O)cc1 T0635 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.1 OCCCc1ccc(O)cc1 T3738 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.16 CCCC(=O)c1ccccc1 T20324 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.24 CNCCc1cccc(O)c1 T34003 [1,1,0,0,0,0|0,0,0]=2 41 B11R1.28 OCCCCc1ccccc1 T20370 [1,1,0,0,0,0|1,0,0]=3 42 B11R1.28 OCCOCc1ccccc1 T14013 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.28 S=C=NCCc1ccccc1 T19687 [1,1,0,0,0,0|0,0,2]=4 44 B11R1.40 CC(Cc1ccccc1)NN T24631 [1,1,0,0,0,0|1,0,0]=3 45 B11R1.91 CC(=O)CCc1ccccc1 TCS1709 [1,1,0,0,0,0|1,0,0]=3 46 B11R1.91 CC(=O)COc1ccccc1 T25944 [1,1,0,0,0,0|2,0,0]=4 47 B11R1.91 CC(=O)NCc1ccccc1 T5924 [1,1,0,0,0,0|2,0,0]=4 48 B11R1.91 CC(=O)OCc1ccccc1 T5615 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.91 OC(=O)CCc1ccccc1 T3731 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.369 CCCCCc1ccc(C)cc1O T4557 [0,2,0,0,0,0|2,0,0]=4 51 B13R1.1511 CCCC(C)c1ccc(C)cc1O T29414 [0,2,0,0,0,0|2,0,0]=4 52 B13R1.91 CNC(C)Cc1ccccc1OC T5035 [0,2,0,0,0,0|1,0,0]=3 53 B11R2.1 O=C1CCc2ccccc12 T0564 [1,0,0,1,0,0|2,0,0]=4 54 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T1025 [1,0,0,1,0,0|2,0,0]=4 55 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T7942 [1,0,0,1,0,0|2,0,0]=4 56 B9R1.12 CNCCc1c[nH]cn1 T23038 [1,0,0,0,1,0|2,0,0]=4