0 B11R1.280 C=Cc1ccc(O)c(OC)c1 T8197 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.280 COc1cc(C=O)ccc1O T6717 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.280 COc1cc(CN)ccc1O T1356 [0,0,0,0,0,0|1,0,1]=2 3 B11R1.280 COc1cc(CO)ccc1O T2860 [0,0,0,0,0,0|1,0,1]=2 4 B10R1.30 CCc1nc(C)ccc1O T7875 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.30 CCc1nc(C)ccc1O T8624 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.176 O=Cc1ccc(O)c(O)c1 T3018 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.56 COc1cc(C(=O)O)ccc1O T9115 [0,1,0,0,0,0|1,0,0]=2 8 B12R1.56 COc1cc(C(C)=O)ccc1O T6391 [0,1,0,0,0,0|0,0,1]=2 9 B12R1.78 COc1ccc(C=O)cc1OC T5657 [0,1,0,0,0,0|1,0,0]=2 10 B12R1.78 COc1ccc(CO)cc1OC T0657 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.270 CCOc1cc(C=O)ccc1O T0491 [0,1,0,0,0,0|1,0,0]=2 12 B12R1.286 C=CCc1ccc(O)c(OC)c1 T1297 [0,1,0,0,0,0|0,0,0]=1 13 B12R1.286 COc1cc(CCN)ccc1O T4710 [0,1,0,0,0,0|0,0,2]=3 14 B12R1.286 COc1cc(CCN)ccc1O T8269 [0,1,0,0,0,0|0,0,2]=3 15 B12R1.286 COc1cc(CCO)ccc1O TN1742 [0,1,0,0,0,0|0,0,2]=3 16 B12R1.286 C\C=C\c1ccc(O)c(OC)c1 T2S0493 [0,1,0,0,0,0|0,0,0]=1 17 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 T3760 [0,1,0,0,0,0|2,0,1]=4 18 B9R1.2 CNc1cccc(C)c1 T0557 [2,0,0,0,0,0|1,0,1]=4 19 B9R1.2 O=Cc1cccc(O)c1 T4778 [2,0,0,0,0,0|1,0,0]=3 20 B9R1.2 OCc1cccc(O)c1 T4760 [2,0,0,0,0,0|1,0,1]=4 21 B9R1.15 COc1ccccc1O T1301 [2,0,0,0,0,0|0,0,0]=2 22 B9R1.15 COc1ccccc1O T3267 [2,0,0,0,0,0|0,0,0]=2 23 B9R1.15 OCc1ccccc1O T0311 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.69 Cc1ccc(O)c(O)c1 T4779 [2,0,0,0,0,0|0,0,1]=3 25 B9R1.69 NC1=C(O)C=C(F)C=C1 T1370 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.1 CCc1ccc(O)cc1 T5883 [2,0,0,0,0,0|0,0,2]=4 27 B9R1.1 COc1ccc(O)cc1 T0501 [2,0,0,0,0,0|1,0,1]=4 28 B9R1.1 O=Cc1ccc(O)cc1 T2S1814 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.1 OCC1=CC=C(O)C=C1 T3752 [2,0,0,0,0,0|1,0,1]=4 30 B11R1.37 COc1ccc(O)cc1OC T3745 [1,1,0,0,0,0|1,0,0]=3 31 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 TCS2170 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.9 COc1cc(O)cc(OC)c1 T7438 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.189 COc1cccc(CCN)c1 T7855 [1,1,0,0,0,0|0,0,2]=4 34 B11R1.266 COc1cccc(C(=O)O)c1 T5982 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.266 COc1cccc(C(N)=O)c1 T7439 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.14 O=Cc1cc(O)c(O)c(O)c1 T7972 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.21 CC(=O)c1ccc(O)c(O)c1 T3734 [1,1,0,0,0,0|0,0,1]=3 38 B11R1.21 Cc1cc(C(=O)O)ccc1O T5298 [1,1,0,0,0,0|1,0,0]=3 39 B11R1.21 Nc1cc(C(=O)O)ccc1O T4770 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.21 O=C(O)c1ccc(Br)c(O)c1 T7454 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.21 O=C(O)c1ccc(O)c(O)c1 T0562 [1,1,0,0,0,0|1,0,0]=3 42 B11R1.192 C=CCc1ccc(O)c(O)c1 TN1274 [1,1,0,0,0,0|0,0,0]=2 43 B11R1.192 NCCc1ccc(O)c(O)c1 T1644 [1,1,0,0,0,0|0,0,2]=4 44 B11R1.192 OCCc1ccc(O)c(O)c1 T3412 [1,1,0,0,0,0|0,0,2]=4 45 B11R1.279 COC1=C(O)C=C(C=O)C=C1 T3740 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.49 COC(=O)c1ccc(O)c(OC)c1 T2818 [0,2,0,0,0,0|0,0,1]=3 47 B13R1.49 COc1cc(C(O)CN)ccc1O T4945 [0,2,0,0,0,0|0,0,2]=4 48 B13R1.50 COc1cc(S(=O)(=O)[O-])ccc1O T0284 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.298 COc1cc(C(=O)O)cc(O)c1O TN1237 [0,2,0,0,0,0|1,0,0]=3 50 B13R1.3091 COc1ccc(C(=O)O)cc1OC T3744 [0,2,0,0,0,0|1,0,0]=3 51 B13R1.386 C=CCc1ccc(OC)c(OC)c1 T3S2259 [0,2,0,0,0,0|0,0,0]=2 52 B13R1.386 COc1ccc(CC#N)cc1OC T0563 [0,2,0,0,0,0|0,0,2]=4 53 B13R1.386 C\C=C\c1ccc(OC)c(OC)c1 T5661 [0,2,0,0,0,0|0,0,0]=2 54 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 T3S0507 [0,2,0,0,0,0|0,0,1]=3 55 B13R1.575 COc1cc(CCCO)ccc1O TN1578 [0,2,0,0,0,0|0,0,2]=4 56 B13R1.575 COc1cc(\C=C\C=O)ccc1O T2S1907 [0,2,0,0,0,0|0,0,0]=2 57 B13R1.575 COc1cc(\C=C\CO)ccc1O TL0010 [0,2,0,0,0,0|0,0,0]=2 58 B13R1.433 COc1cc(C=O)cc(OC)c1O T3747 [0,2,0,0,0,0|1,0,0]=3 59 B13R1.433 COc1cc(CO)cc(OC)c1O T8018 [0,2,0,0,0,0|1,0,1]=4 60 B11R1.1 COCCc1ccc(O)cc1 T0635 [0,0,1,1,0,0|0,0,2]=4 61 B11R1.1 OC\C=C\c1ccc(O)cc1 TN2028 [0,0,1,1,0,0|2,0,0]=4 62 B11R2.36 Oc1ccc2c(c1)OCO2 T3676 [1,0,0,1,0,0|1,0,0]=3