0 B10R1.18 CC(=O)Oc1ccccc1 T0650 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 O=C(O)Cc1cccnc1 T1366 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.8 NCCC1=NC=CC=C1 T22501 [1,0,0,0,0,0|1,0,0]=2 3 B9R1.8 NCCc1ccccc1 T2935 [1,0,0,0,0,0|0,0,0]=1 4 B9R1.8 NCCc1ccccc1 T7433 [1,0,0,0,0,0|0,0,0]=1 5 B9R1.8 O=CCC1=CC=CC=C1 TCS1857 [1,0,0,0,0,0|1,0,1]=3 6 B9R1.8 OCCC1=CC=CC=C1 T0011 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.8 OCCc1ccccn1 T0658 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [0,1,0,0,0,0|2,0,1]=4 9 B11R1.20 CC(=O)Oc1ccc(O)cc1 T8704 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.20 O=C(O)Cc1ccc(O)cc1 T3743 [0,1,0,0,0,0|2,0,1]=4 11 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 T8577 [0,1,0,0,0,0|0,0,0]=1 12 B11R1.36 O=C(O)C(O)c1ccccc1 T4848 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.36 O=C(O)[C@H](O)c1ccccc1 T2S0122 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.86 O=C(O)Cc1ccccc1O T5308 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.157 CC(=O)Nc1cccc(O)c1 T0914 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.157 CC(=O)OC1=CC=CC(O)=C1 T0339 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.157 O=C(O)Cc1cccc(O)c1 T4829 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.509 O=S(=O)(F)Cc1ccccc1 T0789 [0,1,0,0,0,0|3,0,0]=4 19 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T1025 [0,0,0,1,0,0|0,0,0]=1 20 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T7942 [0,0,0,1,0,0|0,0,0]=1 21 B11R2.10 Nc1nc2ccccc2s1 T1347 [0,0,0,1,0,0|2,0,1]=4 22 B11R2.10 O=C1Cc2ccccc2N1 Fr16741 [0,0,0,1,0,0|1,0,1]=3 23 B9R1.6 CC(=O)c1ccccc1 T7446 [0,0,0,0,1,0|1,0,1]=3 24 B9R1.6 C[C@H](O)c1ccccc1 T4784 [0,0,0,0,1,0|1,0,0]=2 25 B9R1.6 N=C(N)c1ccccc1 T8362 [0,0,0,0,1,0|1,0,1]=3 26 B9R1.6 NC(=O)C1=CC=CC=C1 T6780 [0,0,0,0,1,0|1,0,1]=3 27 B9R1.6 NC(=O)C1=CC=CC=N1 T6942 [0,0,0,0,1,0|2,0,1]=4 28 B9R1.6 NC(=O)C1=CC=NC=C1 T0552 [0,0,0,0,1,0|2,0,1]=4 29 B9R1.6 NC(=O)C1=CN=CC=C1 T0934 [0,0,0,0,1,0|2,0,1]=4 30 B9R1.6 NC(=S)C1=CC=NC=C1 T1365 [0,0,0,0,1,0|2,0,1]=4 31 B9R1.6 O=C(O)c1ccccc1 T0833 [0,0,0,0,1,0|2,0,1]=4 32 B9R1.6 O=C([O-])c1ccccc1 T8124 [0,0,0,0,1,0|2,0,1]=4 33 B11R1.91 CC(=O)CCC1=CC=CC=C1 TCS1709 [0,0,0,0,0,1|1,0,1]=3 34 B11R1.91 CC(=O)NCc1ccccc1 T5924 [0,0,0,0,0,1|1,0,1]=3 35 B11R1.91 CC(=O)OCc1ccccc1 T5615 [0,0,0,0,0,1|1,0,1]=3 36 B11R1.91 CC(=O)\C=C\c1ccccc1 TCS1554 [0,0,0,0,0,1|1,0,2]=4 37 B11R1.91 O=C(O)CCc1ccccc1 T3731 [0,0,0,0,0,1|2,0,1]=4 38 B8R1.2 NCc1cccnc1 T1581 [2,0,0,0,0,0|1,0,0]=3 39 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [2,0,0,0,0,0|1,0,1]=4 40 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|1,0,0]=3 41 B8R1.2 OCc1ccccn1 T1112 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.2 OCc1cccnc1 T1299 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.1 N#CCc1ccc(O)cc1 Fr16745 [1,1,0,0,0,0|0,0,2]=4 44 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|0,0,0]=2 45 B10R1.1 NCCc1ccc(O)cc1 T3095 [1,1,0,0,0,0|0,0,0]=2 46 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|0,0,0]=2 47 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|1,0,0]=3 48 B10R1.10 NCCC1=CC(O)=CC=C1 T11937L [1,1,0,0,0,0|0,0,0]=2 49 B10R1.15 NCC(O)c1ccccc1 T4873 [1,1,0,0,0,0|0,0,0]=2 50 B10R1.15 OCC(O)c1ccccc1 T1346 [1,1,0,0,0,0|1,0,0]=3 51 B10R1.17 CNCCc1ccccn1 T0246 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.17 CNCCc1ccccn1 T0246L [1,1,0,0,0,0|1,0,0]=3 53 B10R1.17 CNCCc1ccccn1 T4195 [1,1,0,0,0,0|1,0,0]=3 54 B10R1.17 NNCCc1ccccc1 T12441 [1,1,0,0,0,0|0,0,0]=2 55 B10R1.17 OCCCC1=CC=CC=C1 T3754 [1,1,0,0,0,0|0,0,0]=2 56 B10R1.17 OC\C=C\C1=CC=CC=C1 T5S1550 [1,1,0,0,0,0|0,0,2]=4 57 B10R1.17 S=C=NCc1ccccc1 T1082 [1,1,0,0,0,0|1,0,1]=4 58 B10R1.13 CC(=O)C1=CC=C(O)C=C1 T3750 [0,1,0,0,1,0|1,0,1]=4 59 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 T6781 [0,1,0,0,1,0|2,0,0]=4 60 B10R1.61 CC(=O)C1=CC=CC=C1O TCS1856 [0,1,0,0,1,0|1,0,1]=4 61 B10R1.61 NC(=O)C1=CC=CC=C1O T0004 [0,1,0,0,1,0|1,0,1]=4 62 B10R1.113 NC(=O)c1cccc(N)c1 T6329 [0,1,0,0,1,0|1,0,1]=4 63 B12R1.21 CC(=O)CCc1ccc(O)cc1 T2S0633 [0,1,0,0,0,1|1,0,1]=4 64 B12R1.21 CN(C)CCc1ccc(O)cc1 T2890 [0,1,0,0,0,1|2,0,0]=4 65 B12R1.49 COC(=O)Cc1ccc(O)cc1 TN1436 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 T0279 [0,2,0,0,0,0|0,0,0]=2 67 B12R1.32 C#CCN(C)Cc1ccccc1 T0300 [0,2,0,0,0,0|2,0,0]=4 68 B12R1.32 C#CCN(C)Cc1ccccc1 T1578 [0,2,0,0,0,0|2,0,0]=4 69 B10R2.7 c1ccc2c(c1)CCO2 Fr14127 [1,0,0,1,0,0|1,0,0]=3 70 B12R2.24 O=C1CCc2ccccc2C1 T0660 [0,0,0,1,0,1|1,0,1]=4 71 B12R2.18 CC1C(=O)Nc2ccccc21 T0538 [0,1,0,1,0,0|1,0,1]=4 72 B8R1.8 NCCC1=CNC=N1 T6535 [1,0,0,0,1,0|2,0,0]=4