0 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.61 O=C(O)c1ccccc1O T0649 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.6 C[C@H](O)c1ccccc1 T4784 [1,0,0,0,0,0|1,0,0]=2 3 B9R1.6 NC(=O)C1=CC=CC=C1 BBP01204 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.6 O=C(O)C1=CC=CC=C1 BBP00049 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.6 O=C(O)c1ccccc1 T0833 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.15 COc1ccccc1O T1301 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.15 OCC1=CC=CC=C1O BBP00748 [1,0,0,0,0,0|1,0,0]=2 8 B9R1.15 OCc1ccccc1O T0311 [1,0,0,0,0,0|1,0,0]=2 9 B11R1.159 O=C(O)c1cccc(O)c1O T4810 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 BBP05006 [0,1,0,0,0,0|1,0,1]=3 11 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 BBP00273 [0,1,0,0,0,0|1,0,1]=3 12 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 T3751 [0,1,0,0,0,0|1,0,1]=3 13 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 BBP04040 [0,1,0,0,0,0|0,0,0]=1 14 B11R1.166 Cc1ccc(C(C)C)c(O)c1 T3S0717 [0,1,0,0,0,0|0,0,0]=1 15 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 BBP04650 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 TCS2170 [0,1,0,0,0,0|1,0,1]=3 17 B11R1.167 O=C(O)c1cc(O)ccc1O T2857 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.222 COC(=O)C1=C(O)C=CC=C1 BBP04331 [0,1,0,0,0,0|1,0,1]=3 19 B11R1.222 COC(=O)c1ccccc1O T0399 [0,1,0,0,0,0|1,0,1]=3 20 B8R1.2 NCC1=CC=CC=C1 BBP04286 [2,0,0,0,0,0|1,0,0]=3 21 B8R1.2 NCc1ccccc1 T4846 [2,0,0,0,0,0|1,0,0]=3 22 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [2,0,0,0,0,0|1,0,1]=4 23 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|1,0,0]=3 24 B8R1.5 O=C1C=COC=C1O BBP03674 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.5 OC1=C(O)C=CC=C1 BBP01074 [2,0,0,0,0,0|1,0,0]=3 26 B8R1.5 Oc1ccccc1O T4847 [2,0,0,0,0,0|1,0,0]=3 27 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BBP00283 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.15 NCC(O)c1ccccc1 T4873 [1,1,0,0,0,0|1,0,0]=3 29 B10R1.30 O=CC1=C(O)C=CC(O)=C1 BBP01230 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.1021 CC(C)c1cccc(O)c(=O)c1 T3717 [0,1,0,0,0,1|0,0,1]=3 31 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O BBP01774 [0,2,0,0,0,0|1,0,1]=4 32 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O BBP02841 [0,2,0,0,0,0|1,0,1]=4 33 B12R1.1000 CC(=O)c1c(O)cc(O)cc1O T2840 [0,2,0,0,0,0|1,0,1]=4 34 B12R1.3441 COC(=O)C1=C(O)C=CC=C1O BBP04357 [0,2,0,0,0,0|1,0,1]=4 35 B12R1.232 CC1=CC(=O)C(C(C)C)=CC1=O T4088 [0,2,0,0,0,0|0,0,1]=3 36 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 BBP00050 [0,2,0,0,0,0|1,0,1]=4 37 B12R1.452 COc1ccc(C(C)=O)c(O)c1 T2900 [0,2,0,0,0,0|1,0,1]=4 38 B12R1.1703 CC1=CC(O)=C(C(C)CO)C=C1 BBP04422 [0,2,0,0,0,0|0,0,0]=2 39 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 BBP00328 [0,2,0,0,0,0|1,0,1]=4 40 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 T3760 [0,2,0,0,0,0|1,0,1]=4 41 B12R2.18 C[C@H]1C2=C(C=CN=C2)C[C@H]1O BBP02775 [0,1,0,1,0,0|2,0,0]=4