0 B11R1.3 CC(C)c1ccc(C=O)cc1 T7441 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.3 CC(C)c1ccc(CO)cc1 T7442 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.3 NCc1ccc(cc1)C(O)=O T1252 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.3 COc1ccc(C=O)cc1 T7910 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.3 COc1ccc(CO)cc1 T20309 [1,0,0,0,0,0|1,0,0]=2 5 B10R1.13 CC(=O)c1ccc(C)cc1 T19137 [1,0,0,0,0,0|1,0,1]=3 6 B10R1.13 CC(=O)c1ccc(O)cc1 T3750 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.13 CC(C)C1=CC=C(C)CC1 T7909 [1,0,0,0,0,0|0,0,2]=3 8 B10R1.13 CC(C)C1=CCC(C)=CC1 TN2031 [1,0,0,0,0,0|0,0,2]=3 9 B10R1.13 CC(C)C1CC=C(C)C=C1 TN6990 [1,0,0,0,0,0|0,0,2]=3 10 B10R1.13 CC(C)[C@H]1CC=C(C)C=C1 T8289 [1,0,0,0,0,0|0,0,2]=3 11 B10R1.13 Cc1ccc(cc1)C(N)N T35198 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.13 Cc1ccc(cc1)C(O)=O Fr14438 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.13 NC(=O)c1ccc(O)cc1 TN3041 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.13 OC(=O)c1ccc(O)cc1 T2989 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.256 CC(C)c1ccc(cc1)C(O)=O T20488 [0,1,0,0,0,0|0,0,1]=2 16 B9R0.1 C/C(C)=C/CC=C(C)C=C TN6815 [1,0,1,0,0,0|0,0,2]=4 17 B9R0.1 C\C(C)=C/C=C/C(C)=C/C T20298 [1,0,1,0,0,0|0,0,2]=4 18 B9R1.1 CCc1ccc(O)cc1 T5883 [2,0,0,0,0,0|0,0,0]=2 19 B9R1.1 COc1ccc(F)cc1 T0528 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.1 COc1ccc(O)cc1 T0501 [2,0,0,0,0,0|1,0,0]=3 21 B9R1.1 NCc1ccc(O)cc1 T21095 [2,0,0,0,0,0|1,0,0]=3 22 B9R1.1 OCc1ccc(O)cc1 T3752 [2,0,0,0,0,0|1,0,0]=3 23 B9R1.1 OCc1ccc(cn1)O T40502 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.1 Oc1ccc(C=C)cc1 T13509 [2,0,0,0,0,0|0,0,2]=4 25 B9R1.1 Oc1ccc(C=O)cc1 T2S1814 [2,0,0,0,0,0|1,0,1]=4 26 B9R1.6 CC(=O)c1ccccc1 T7446 [2,0,0,0,0,0|1,0,1]=4 27 B9R1.6 C[C@H](O)c1ccccc1 T4784 [2,0,0,0,0,0|1,0,0]=3 28 B11R1.83 COc1ccc(CC=C)cc1 T5649 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.279 CCc1ccc(OC)c(O)c1 T32841 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.279 COc1ccc(CO)cc1O TN6810 [1,1,0,0,0,0|1,0,0]=3 31 B11R1.21 CC(=O)c1ccc(O)c(O)c1 T3734 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.21 CC(C)C1=CC(=C(C=C1)O)O T9065 [1,1,0,0,0,0|0,0,0]=2 33 B11R1.21 CC(C)c1ccc(C)c(O)c1 T4S1990 [1,1,0,0,0,0|0,0,0]=2 34 B11R1.22 C/C(=N\O)c1ccc(O)cc1 T10143 [1,1,0,0,0,0|1,0,1]=4 35 B11R1.22 CCC(C)c1ccc(O)cc1 T12515 [1,1,0,0,0,0|0,0,0]=2 36 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [1,1,0,0,0,0|1,0,1]=4 37 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.22 Oc1ccc(cc1)C(=O)CBr T7084 [1,1,0,0,0,0|1,0,1]=4 39 B11R1.166 CC(=O)c1ccc(C)cc1O Fr14298 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.166 CC(=O)c1ccc(O)cc1O T3751 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.166 CC(C)c1ccc(C)cc1O T3S0717 [1,1,0,0,0,0|0,0,0]=2 42 B13R1.585 CC(C)Cc1ccc(cc1)C(C)=O T0597 [0,1,0,0,0,1|0,0,2]=4 43 B13R1.585 CC(C)Oc1ccc(cc1)C(O)=O T24977 [0,1,0,0,0,1|0,0,1]=3 44 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)C T0549 [0,2,0,0,0,0|0,0,2]=4 45 B11R1.20 CC(=O)Nc1ccc(C)cc1 T33859 [1,0,0,0,0,1|1,0,1]=4 46 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [1,0,0,0,0,1|1,0,1]=4 47 B11R1.20 CC(=O)Oc1ccc(O)cc1 T8704 [1,0,0,0,0,1|1,0,1]=4 48 B11R1.266 CCc1cccc(c1)C(C)C T31110 [0,0,0,0,1,1|1,0,0]=3