0 B10R1.18 CC(=O)Oc1ccccc1 T0650 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 O=C(O)Cc1cccnc1 T1366 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.8 NCCC1=NC=CC=C1 T22501 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.8 NCCc1ccccc1 T2935 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.8 NCCc1ccccc1 T7433 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 O=CCC1=CC=CC=C1 TCS1857 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.8 OCCC1=CC=CC=C1 T0011 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.8 OCCc1ccccn1 T0658 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 T8577 [0,1,0,0,0,0|2,0,0]=3 9 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T1025 [0,0,0,1,0,0|2,0,0]=3 10 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T7942 [0,0,0,1,0,0|2,0,0]=3 11 B9R1.6 CC(=O)c1ccccc1 T7446 [0,0,0,0,1,0|2,0,1]=4 12 B9R1.6 CC(=O)c1cnccn1 T5596 [0,0,0,0,1,0|2,0,1]=4 13 B9R1.6 C[C@H](O)c1ccccc1 T4784 [0,0,0,0,1,0|2,0,0]=3 14 B9R1.6 NC(=O)C1=CN=CC=C1 T0934 [0,0,0,0,1,0|2,0,1]=4 15 B9R1.6 O=C(O)c1cccnc1 T0879 [0,0,0,0,1,0|2,0,1]=4 16 B11R1.91 CC(=O)CCC1=CC=CC=C1 TCS1709 [0,0,0,0,0,1|2,0,1]=4 17 B11R1.91 CC(=O)NCc1ccccc1 T5924 [0,0,0,0,0,1|2,0,1]=4 18 B11R1.91 CC(=O)OCc1ccccc1 T5615 [0,0,0,0,0,1|2,0,1]=4 19 B8R1.2 NCc1cccnc1 T1581 [2,0,0,0,0,0|1,0,0]=3 20 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.2 OCc1cccnc1 T1299 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|2,0,0]=4 23 B10R1.1 NCCc1ccc(O)cc1 T3095 [1,1,0,0,0,0|2,0,0]=4 24 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|2,0,0]=4 25 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|2,0,0]=4 26 B10R1.10 NCCC1=CC(O)=CC=C1 T11937L [1,1,0,0,0,0|2,0,0]=4 27 B10R1.15 CNC(=O)c1cccnc1 T5233 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.15 COC(=O)c1cccnc1 T5562 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.15 NCC(O)c1ccccc1 T4873 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.15 OCC(O)c1ccccc1 T1346 [1,1,0,0,0,0|2,0,0]=4 31 B10R1.17 CNCCc1ccccn1 T0246 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.17 CNCCc1ccccn1 T0246L [1,1,0,0,0,0|2,0,0]=4 33 B10R1.17 CNCCc1ccccn1 T4195 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.17 NNCCc1ccccc1 T12441 [1,1,0,0,0,0|2,0,0]=4 35 B10R1.17 OCCCC1=CC=CC=C1 T3754 [1,1,0,0,0,0|1,0,0]=3 36 B10R1.13 CC1=CC=C(C(C)C)CC1 T7909 [0,1,0,0,1,0|1,0,1]=4 37 B10R1.13 CC1=CCC(C(C)C)=CC1 TN2031 [0,1,0,0,1,0|1,0,1]=4 38 B12R1.21 CN(C)CCc1ccc(O)cc1 T2890 [0,1,0,0,0,1|2,0,0]=4 39 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 T0279 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.32 C#CCN(C)Cc1ccccc1 T0300 [0,2,0,0,0,0|2,0,0]=4 41 B12R1.32 C#CCN(C)Cc1ccccc1 T1578 [0,2,0,0,0,0|2,0,0]=4 42 B10R2.7 c1ccc2c(c1)CCO2 Fr14127 [1,0,0,1,0,0|2,0,0]=4 43 B8R1.8 NCCC1=CNC=N1 T6535 [1,0,0,0,1,0|2,0,0]=4