0 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 BBP05006 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 BBP00273 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 T3751 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 BBP04040 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 Cc1ccc(C(C)C)c(O)c1 T3S0717 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 O=C(O)c1cnc(O)nc1O T4711 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BBP00283 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.13 Nc1ccc(C(=O)O)cc1 T1311 [1,0,0,0,0,0|1,0,0]=2 8 B10R1.13 O=C(O)C1=CC=C(O)C=C1 BBP00210 [1,0,0,0,0,0|0,0,0]=1 9 B10R1.13 O=C(O)C1=CC=C(O)C=C1 T2989 [1,0,0,0,0,0|0,0,0]=1 10 B10R1.13 O=C(O)c1ccc(O)nc1 T4816 [1,0,0,0,0,0|1,0,0]=2 11 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [1,0,0,0,0,0|1,0,0]=2 12 B10R1.61 O=C(O)c1ccccc1O T0649 [1,0,0,0,0,0|0,0,0]=1 13 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 BBP05047 [0,1,0,0,0,0|0,0,0]=1 14 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 BBP00050 [0,1,0,0,0,0|1,0,0]=2 15 B12R1.452 COc1ccc(C(=O)O)c(O)c1 T2A2428 [0,1,0,0,0,0|0,0,0]=1 16 B12R1.452 COc1ccc(C(C)=O)c(O)c1 T2900 [0,1,0,0,0,0|1,0,0]=2 17 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O BBP02841 [0,1,0,0,0,0|1,0,0]=2 18 B12R1.1000 CC(=O)c1c(O)cc(O)cc1O T2840 [0,1,0,0,0,0|1,0,0]=2 19 B12R1.1000 CC1=CC(O)=CC(O)=C1C(=O)O BBP03174 [0,1,0,0,0,0|0,0,0]=1 20 B12R1.1000 Cc1cc(O)cc(O)c1C(=O)O T2839 [0,1,0,0,0,0|0,0,0]=1 21 B12R1.1703 CC1=CC(O)=C(C(C)CO)C=C1 BBP04422 [0,1,0,0,0,0|2,0,1]=4 22 B12R1.233 O=C(O)CC1=C(O)C=C(O)C=C1 BBP01536 [0,0,0,0,0,1|0,0,0]=1 23 B9R1.1 O=CC1=CC=C(O)C=C1 BBP00159 [2,0,0,0,0,0|0,0,0]=2 24 B9R1.1 O=Cc1ccc(O)cc1 T2S1814 [2,0,0,0,0,0|0,0,0]=2 25 B9R1.1 OCC1=CC=C(O)C=C1 BBP00170 [2,0,0,0,0,0|0,0,1]=3 26 B9R1.1 OCC1=CC=C(O)C=C1 T3752 [2,0,0,0,0,0|0,0,1]=3 27 B9R1.6 C[C@H](O)c1ccccc1 T4784 [2,0,0,0,0,0|1,0,1]=4 28 B9R1.6 NC(=O)C1=CC=CC=C1 BBP01204 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.6 NC(=O)C1=CC=CN=C1 BBP05373 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.6 NC(=O)C1=CN=CC=C1 T0934 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.6 O=C(O)C1=CC=CC=C1 BBP00049 [2,0,0,0,0,0|0,0,0]=2 32 B9R1.6 O=C(O)C1=CC=CN=C1 BBP05316 [2,0,0,0,0,0|1,0,0]=3 33 B9R1.6 O=C(O)c1ccccc1 T0833 [2,0,0,0,0,0|0,0,0]=2 34 B9R1.6 O=C(O)c1ccccn1 T4850 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.6 O=C(O)c1cccnc1 T0879 [2,0,0,0,0,0|1,0,0]=3 36 B9R1.15 COc1ccccc1O T1301 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.15 OCC1=CC=CC=C1O BBP00748 [2,0,0,0,0,0|0,0,1]=3 38 B9R1.15 OCc1ccccc1O T0311 [2,0,0,0,0,0|0,0,1]=3 39 B9R1.69 CC1=C(O)C=CC(O)=C1 BBP04832 [2,0,0,0,0,0|1,0,0]=3 40 B9R1.69 Cc1ccc(O)c(O)c1 T4779 [2,0,0,0,0,0|1,0,0]=3 41 B11R1.3 COC1=CC=C(C(=O)O)C=C1 TCS0862 [1,1,0,0,0,0|0,0,0]=2 42 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 BBP02583 [1,1,0,0,0,0|1,0,0]=3 43 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 BBP00864 [1,1,0,0,0,0|0,0,0]=2 44 B11R1.21 O=C(O)c1ccc(O)c(O)c1 T0562 [1,1,0,0,0,0|0,0,0]=2 45 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 BBP02463 [1,1,0,0,0,0|1,0,0]=3 46 B11R1.22 CCC(=O)c1ccc(O)cc1 T0021 [1,1,0,0,0,0|1,0,0]=3 47 B11R1.22 COC(=O)C1=CC=C(O)C=C1 BBP00471 [1,1,0,0,0,0|0,0,0]=2 48 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [1,1,0,0,0,0|0,0,0]=2 49 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [1,1,0,0,0,0|1,0,1]=4 50 B11R1.37 COC1=C(OC)C=C(O)C=C1 BBP01277 [1,1,0,0,0,0|2,0,0]=4 51 B11R1.81 N#CCC1=C(O)C=C(O)C=C1 BBP01498 [1,1,0,0,0,0|1,0,1]=4 52 B11R1.279 COC1=C(O)C=C(CO)C=C1 BBP05133 [1,1,0,0,0,0|2,0,0]=4 53 B11R1.279 COC1=CC(O)=C(C=O)C=C1 BBP05066 [1,1,0,0,0,0|0,0,0]=2 54 B11R1.279 COc1ccc(C=O)c(O)c1 T2A2524 [1,1,0,0,0,0|0,0,0]=2 55 B11R1.159 Nc1c(O)cccc1C(=O)O T4707 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.159 O=C(O)c1cccc(O)c1O T4810 [1,1,0,0,0,0|0,0,0]=2 57 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 BBP04650 [1,1,0,0,0,0|1,0,0]=3 58 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 TCS2170 [1,1,0,0,0,0|1,0,0]=3 59 B11R1.167 O=C(O)c1cc(O)ccc1O T2857 [1,1,0,0,0,0|0,0,0]=2 60 B11R1.222 COC(=O)C1=C(O)C=CC=C1 BBP04331 [1,1,0,0,0,0|0,0,0]=2 61 B11R1.222 COC(=O)c1ccccc1O T0399 [1,1,0,0,0,0|0,0,0]=2 62 B13R1.315 COC1=CC(O)=CC(O)=C1C(C)=O BBP00196 [0,2,0,0,0,0|1,0,0]=3 63 B13R1.428 COC1=CC(O)=C(C(C)=O)C(O)=C1 BBP03596 [0,2,0,0,0,0|1,0,0]=3 64 B13R1.3096 COC1=C(O)C(O)=C(C(C)=O)C=C1 BBP03606 [0,2,0,0,0,0|1,0,0]=3 65 B13R1.3230 COC1=C(O)C=CC(C(C)=O)=C1O BBP04713 [0,2,0,0,0,0|1,0,0]=3 66 B13R1.4656 COC(=O)C1=C(O)C=C(O)C=C1C BBP01305 [0,2,0,0,0,0|0,0,0]=2 67 B11R1.157 O=C(O)Cc1cccc(O)c1 T4829 [0,0,1,1,0,0|1,0,1]=4 68 B11R2.36 OC1=CC2=C(C=C1)OCO2 BBP03902 [1,0,0,1,0,0|2,0,0]=4 69 B11R2.36 Oc1ccc2c(c1)OCO2 T3676 [1,0,0,1,0,0|2,0,0]=4 70 B13R2.3683 O=c1ccc2cc(O)ccc2o1 T2S0357 [0,0,0,1,0,1|2,0,0]=4 71 B13R2.11642 O=C1OCC2=C1C(O)=CC(O)=C2 BBP05121 [0,1,0,1,0,0|0,0,0]=2 72 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [1,0,0,0,0,1|1,0,0]=3 73 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 BBP02607 [1,0,0,0,0,1|0,0,0]=2 74 B11R1.20 O=C(O)Cc1ccc(O)cc1 T3743 [1,0,0,0,0,1|0,0,0]=2 75 B11R1.74 O=C(O)c1cc(O)cc(O)c1 T0570 [0,0,0,0,1,1|0,0,0]=2 76 B13R1.164 O=C(O)CCC1=C(O)C=C(O)C=C1 BBP02106 [0,0,0,0,0,2|0,0,0]=2 77 B13R1.164 O=C(O)CCc1ccc(O)cc1O T3737 [0,0,0,0,0,2|0,0,0]=2