0 B9R1.1 CCc1ccc(O)cc1 T5883 [1,0,0,0,0,0|2,0,0]=3 1 B9R1.1 COc1ccc(F)cc1 T0528 [1,0,0,0,0,0|1,0,0]=2 2 B9R1.1 COc1ccc(O)cc1 T0501 [1,0,0,0,0,0|1,0,0]=2 3 B9R1.1 O=Cc1ccc(O)cc1 T2S1814 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.1 OCC1=CC=C(O)C=C1 T3752 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.15 COc1ccccc1O T1301 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.15 COc1ccccc1O T3267 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.15 OCc1ccccc1O T0311 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.69 Cc1ccc(N)c(N)c1 T7988 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.69 Cc1ccc(O)c(O)c1 T4779 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.69 NC1=C(O)C=C(F)C=C1 T1370 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.37 COc1ccc(O)cc1OC T3745 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 T3751 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.166 CC(=O)c1ccc(C)cc1O Fr14298 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.166 Cc1ccc(C(C)C)c(O)c1 T3S0717 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.279 COC1=C(O)C=C(C=O)C=C1 T3740 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.279 COc1ccc(C=O)c(O)c1 T2A2524 [0,1,0,0,0,0|3,0,0]=4 17 B11R2.36 Oc1ccc2c(c1)OCO2 T3676 [0,0,0,1,0,0|2,0,0]=3 18 B9R1.22 CC1=CC(C)=C(C=O)N1 T21347 [0,0,0,0,1,0|3,0,0]=4 19 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [2,0,0,0,0,0|2,0,0]=4 20 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.3 Cc1cnc(C)cn1 T4801 [2,0,0,0,0,0|2,0,0]=4 22 B8R1.3 Clc1ccc(Cl)cc1 T7431 [2,0,0,0,0,0|2,0,0]=4 23 B8R1.5 Nc1ncccc1O T7923 [2,0,0,0,0,0|2,0,0]=4 24 B8R1.5 O=c1ccocc1O TL0015 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.5 ON1C=CC=CC1=S T12593 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|2,0,0]=4 27 B10R1.1 NCCc1ccc(O)cc1 T3095 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.3 COc1ccc(C=O)cc1 T7910 [1,1,0,0,0,0|0,0,1]=3 31 B10R1.13 CC(=O)C1=CC=C(O)C=C1 T3750 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.13 Cc1ccc(C(=O)O)cc1 Fr14438 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.2 COc1cccc(Cl)c1Cl T1358 [1,1,0,0,0,0|1,0,0]=3 34 B10R1.20 COc1ccccc1CN T1372 [1,1,0,0,0,0|0,0,0]=2 35 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.61 Cc1ccccc1C(=O)O T8068 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.22 CC1=CC(=O)C=C(C)C1=O T4406 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.22 Cc1cc(O)cc(C)c1Cl T0898 [1,1,0,0,0,0|2,0,0]=4 39 B10R1.22 Oc1c(I)cc(I)cc1I T8628 [1,1,0,0,0,0|2,0,0]=4 40 B10R1.118 Cc1nc(C)c(C)nc1C T2722 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.118 Cc1nc(C)c(C)nc1C T2953 [1,1,0,0,0,0|2,0,0]=4 42 B10R1.119 Cc1c(O)c(=O)ccn1C T1565 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.78 COc1ccc(C=O)cc1OC T5657 [0,2,0,0,0,0|0,0,1]=3 44 B12R1.78 COc1ccc(CO)cc1OC T0657 [0,2,0,0,0,0|0,0,0]=2 45 B12R1.69 Nc1ccc(OCCO)c(N)c1 T5672 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.232 CC1=CC(=O)C(C(C)C)=CC1=O T4088 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.452 COc1ccc(C(C)=O)c(O)c1 T2900 [0,2,0,0,0,0|2,0,0]=4 48 B12R1.450 COC1=CC(Cl)=C(OC)C=C1Cl T20532 [0,2,0,0,0,0|1,0,0]=3 49 B12R1.654 COc1ccc(Br)c(C=O)c1O T7483 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.48 COC1=C(O)C=C(C(C)=O)C=C1 T10112 [0,2,0,0,0,0|1,0,0]=3 51 B12R1.48 COc1ccc(C(=O)O)cc1O T5767 [0,2,0,0,0,0|1,0,1]=4 52 B10R2.7 c1ccc2c(c1)CCO2 Fr14127 [1,0,0,1,0,0|0,0,0]=2