0 B10R1.13 C=C1C=CC(C(C)C)CC1 T5621 [0,0,0,0,0,0|0,0,4]=4 1 B10R1.13 CC(=O)C1=CC=C(O)C=C1 T3750 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 CC1=CC=C(C(C)C)CC1 T7909 [0,0,0,0,0,0|0,0,2]=2 3 B10R1.13 CC1=CCC(C(C)C)=CC1 TN2031 [0,0,0,0,0,0|0,0,2]=2 4 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 T8289 [0,0,0,0,0,0|0,0,2]=2 5 B10R1.13 Cc1ccc(C(=O)O)cc1 Fr14438 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 Nc1ccc(C(=O)O)cc1 T1311 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.13 O=C(O)C1=CC=C(O)C=C1 T2989 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.1 CCc1ccc(O)cc1 T5883 [1,0,0,0,0,0|1,0,0]=2 9 B9R1.1 COc1ccc(F)cc1 T0528 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.1 COc1ccc(O)cc1 T0501 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.1 O=Cc1ccc(O)cc1 T2S1814 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.1 OCC1=CC=C(O)C=C1 T3752 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.6 CC(=O)c1ccccc1 T7446 [1,0,0,0,0,0|1,0,1]=3 14 B9R1.6 C[C@H](O)c1ccccc1 T4784 [1,0,0,0,0,0|1,0,0]=2 15 B9R1.6 N=C(N)c1ccccc1 T8362 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.6 NC(=O)C1=CC=CC=C1 T6780 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.6 O=C(O)c1ccccc1 T0833 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.6 O=C([O-])c1ccccc1 T8124 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.3 CC(C)c1ccc(C=O)cc1 T7441 [0,1,0,0,0,0|0,0,1]=2 20 B11R1.3 CC(C)c1ccc(CO)cc1 T7442 [0,1,0,0,0,0|0,0,0]=1 21 B11R1.3 COC1=CC=C(C(=O)O)C=C1 TCS0862 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.3 NCc1ccc(C(=O)O)cc1 T1252 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.21 CC(=O)c1ccc(O)c(O)c1 T3734 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 T4S1990 [0,1,0,0,0,0|0,0,0]=1 25 B11R1.22 CCC(=O)c1ccc(O)cc1 T0021 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.22 CCC(C)C1=CC=C(O)C=C1 T12515 [0,1,0,0,0,0|1,0,0]=2 27 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.22 O=C(CBr)c1ccc(O)cc1 T7084 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 T3751 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.166 CC(=O)c1ccc(C)cc1O Fr14298 [0,1,0,0,0,0|1,0,1]=3 32 B11R1.166 CC1=CC(=O)C(C(C)C)CC1 T8256 [0,1,0,0,0,0|0,0,3]=4 33 B11R1.166 Cc1ccc(C(C)C)c(O)c1 T3S0717 [0,1,0,0,0,0|0,0,0]=1 34 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [0,0,0,0,0,1|2,0,1]=4 35 B11R1.20 CC(=O)Oc1ccc(O)cc1 T8704 [0,0,0,0,0,1|2,0,1]=4 36 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 T8577 [0,0,0,0,0,1|2,0,0]=3 37 B11R1.565 CC(C)C1=CC=CC(=O)C=C1 T19475 [0,0,0,0,0,1|1,0,0]=2 38 B8R1.2 NCc1cccnc1 T1581 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [2,0,0,0,0,0|1,0,1]=4 40 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|1,0,0]=3 41 B8R1.2 OCc1ccccn1 T1112 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.2 OCc1cccnc1 T1299 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.3 Cc1cnc(C)cn1 T4801 [2,0,0,0,0,0|2,0,0]=4 44 B8R1.3 Clc1ccc(Cl)cc1 T7431 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.1 N#CCc1ccc(O)cc1 Fr16745 [1,1,0,0,0,0|1,0,1]=4 46 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|1,0,0]=3 47 B10R1.1 NCCc1ccc(O)cc1 T3095 [1,1,0,0,0,0|1,0,0]=3 48 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|1,0,0]=3 49 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|1,0,0]=3 50 B10R1.3 COc1ccc(C=O)cc1 T7910 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.15 NCC(O)c1ccccc1 T4873 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.15 OCC(O)c1ccccc1 T1346 [1,1,0,0,0,0|1,0,0]=3 53 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.1021 CC(C)c1cccc(O)c(=O)c1 T3717 [0,1,0,0,0,1|1,0,0]=3 55 B12R1.5 COc1ccc(C(=O)CBr)cc1 T7541 [0,2,0,0,0,0|1,0,1]=4 56 B12R1.48 COC1=C(O)C=C(C(C)=O)C=C1 T10112 [0,2,0,0,0,0|1,0,1]=4 57 B12R1.452 COc1ccc(C(C)=O)c(O)c1 T2900 [0,2,0,0,0,0|1,0,1]=4 58 B12R1.232 CC1=CC(=O)C(C(C)C)=CC1=O T4088 [0,2,0,0,0,0|0,0,0]=2 59 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 T13655 [0,2,0,0,0,0|2,0,0]=4 60 B12R1.367 NCC(O)c1ccc(O)c(O)c1 T21066 [0,2,0,0,0,0|2,0,0]=4 61 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T0871 [0,2,0,0,0,0|2,0,0]=4 62 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T1064 [0,2,0,0,0,0|2,0,0]=4 63 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T7044 [0,2,0,0,0,0|2,0,0]=4 64 B12R1.367 OCC(O)c1ccc(O)c(O)c1 TQ0281 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.16 CNCC(O)c1ccc(O)cc1 T1287 [0,2,0,0,0,0|2,0,0]=4 66 B12R1.16 CNCC(O)c1ccc(O)cc1 T6688 [0,2,0,0,0,0|2,0,0]=4 67 B10R1.18 CC(=O)Oc1ccccc1 T0650 [1,0,0,0,0,1|1,0,1]=4 68 B12R1.21 CN(C)CCc1ccc(O)cc1 T2890 [0,0,0,0,0,2|2,0,0]=4