0 B9R1.6 C[C@H](O)c1ccccc1 T4784 [0,0,0,0,0,0|0,1,0]=1 1 B9R1.6 NC(=O)C1=CC=CC=C1 BBP01204 [0,0,0,0,0,0|1,1,1]=3 2 B9R1.6 NC(=O)C1=CC=CN=C1 BBP05373 [0,0,0,0,0,0|2,1,1]=4 3 B9R1.6 NC(=O)C1=CN=CC=C1 T0934 [0,0,0,0,0,0|2,1,1]=4 4 B9R1.6 O=C(O)C1=CC=CC=C1 BBP00049 [0,0,0,0,0,0|1,1,1]=3 5 B9R1.6 O=C(O)C1=CC=CN=C1 BBP05316 [0,0,0,0,0,0|2,1,1]=4 6 B9R1.6 O=C(O)c1ccccc1 T0833 [0,0,0,0,0,0|1,1,1]=3 7 B9R1.6 O=C(O)c1ccccn1 T4850 [0,0,0,0,0,0|2,1,1]=4 8 B9R1.6 O=C(O)c1cccnc1 T0879 [0,0,0,0,0,0|2,1,1]=4 9 B8R1.2 NCC1=CC=CC=C1 BBP04286 [1,0,0,0,0,0|1,0,0]=2 10 B8R1.2 NCc1ccccc1 T4846 [1,0,0,0,0,0|1,0,0]=2 11 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [1,0,0,0,0,0|0,1,1]=3 12 B8R1.2 OCC1=CC=CC=C1 T0732 [1,0,0,0,0,0|0,1,0]=2 13 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BBP00283 [0,1,0,0,0,0|0,1,1]=3 14 B10R1.13 Nc1ccc(C(=O)O)cc1 T1311 [0,1,0,0,0,0|1,1,1]=4 15 B10R1.13 O=C(O)C1=CC=C(O)C=C1 BBP00210 [0,1,0,0,0,0|1,1,1]=4 16 B10R1.13 O=C(O)C1=CC=C(O)C=C1 T2989 [0,1,0,0,0,0|1,1,1]=4 17 B10R1.15 NCC(O)c1ccccc1 T4873 [0,1,0,0,0,0|0,1,0]=2 18 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [0,1,0,0,0,0|0,1,1]=3 19 B10R1.61 O=C(O)c1ccccc1O T0649 [0,1,0,0,0,0|1,1,1]=4 20 B10R1.113 O=C(O)c1cccc(O)c1 T4840 [0,1,0,0,0,0|1,1,1]=4 21 B10R1.18 CC(=O)Oc1ccccc1 T0650 [0,0,0,0,0,1|0,1,1]=3 22 B10R1.18 O=C(O)Cc1ccccc1 T4935 [0,0,0,0,0,1|1,1,1]=4 23 B7R1.3 Nc1ccccc1 T4777 [2,0,0,0,0,0|1,0,0]=3 24 B7R1.3 OC1=CC=CC=C1 TCS0927 [2,0,0,0,0,0|0,1,0]=3 25 B9R1.1 O=CC1=CC=C(O)C=C1 BBP00159 [1,1,0,0,0,0|0,1,1]=4 26 B9R1.1 O=Cc1ccc(O)cc1 T2S1814 [1,1,0,0,0,0|0,1,1]=4 27 B9R1.1 OCC1=CC=C(O)C=C1 BBP00170 [1,1,0,0,0,0|0,1,0]=3 28 B9R1.1 OCC1=CC=C(O)C=C1 T3752 [1,1,0,0,0,0|0,1,0]=3 29 B9R1.2 COC1=CC=CC(O)=C1 BBP00254 [1,1,0,0,0,0|1,0,0]=3 30 B9R1.2 OCc1cccc(O)c1 T4760 [1,1,0,0,0,0|0,1,0]=3 31 B9R1.8 NCCc1ccccc1 T2935 [1,1,0,0,0,0|0,0,0]=2 32 B9R1.8 O=CCC1=CC=CC=C1 TCS1857 [1,1,0,0,0,0|0,0,1]=3 33 B9R1.8 OCCC1=CC=CC=C1 T0011 [1,1,0,0,0,0|0,0,0]=2 34 B9R1.15 COc1ccccc1O T1301 [1,1,0,0,0,0|1,0,0]=3 35 B9R1.15 OCC1=CC=CC=C1O BBP00748 [1,1,0,0,0,0|0,1,0]=3 36 B9R1.15 OCc1ccccc1O T0311 [1,1,0,0,0,0|0,1,0]=3 37 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [0,1,0,0,0,1|0,1,1]=4 38 B11R1.36 C[C@H](O)[C@H](O)C1=CC=CC=C1 BBP03215 [0,1,0,0,0,1|0,1,0]=3 39 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 BBP02583 [0,2,0,0,0,0|0,1,1]=4 40 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 T4S1990 [0,2,0,0,0,0|1,0,0]=3 41 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 BBP02463 [0,2,0,0,0,0|0,1,1]=4 42 B11R1.22 CCC(=O)c1ccc(O)cc1 T0021 [0,2,0,0,0,0|0,1,1]=4 43 B11R1.22 COC(=O)C1=CC=C(O)C=C1 BBP00471 [0,2,0,0,0,0|0,1,1]=4 44 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [0,2,0,0,0,0|0,1,1]=4 45 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [0,2,0,0,0,0|0,1,0]=3 46 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 BBP05006 [0,2,0,0,0,0|0,1,1]=4 47 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 BBP00273 [0,2,0,0,0,0|0,1,1]=4 48 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 T3751 [0,2,0,0,0,0|0,1,1]=4 49 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 BBP04040 [0,2,0,0,0,0|1,0,0]=3 50 B11R1.166 Cc1ccc(C(C)C)c(O)c1 T3S0717 [0,2,0,0,0,0|1,0,0]=3 51 B11R1.222 COC(=O)C1=C(O)C=CC=C1 BBP04331 [0,2,0,0,0,0|0,1,1]=4 52 B11R1.222 COC(=O)c1ccccc1O T0399 [0,2,0,0,0,0|0,1,1]=4 53 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 BBP04650 [0,2,0,0,0,0|0,1,1]=4 54 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 TCS2170 [0,2,0,0,0,0|0,1,1]=4 55 B7R1.1 COC1=COC=C1 BBP00343 [1,0,0,0,1,0|2,0,0]=4 56 B11R1.91 CC(=O)CCC1=CC=CC=C1 TCS1709 [0,0,0,0,0,2|0,1,1]=4 57 B11R1.91 CC(=O)\C=C\c1ccccc1 TCS1554 [0,0,0,0,0,2|0,1,1]=4