0 B8R1.2 OCC1=CC=CC=C1 HMDB0003119 [1,0,0,0,0,0|0,0,1]=2 1 B10R1.15 C=C(C=O)C1=CC=CC=C1 HMDB0060671 [0,1,0,0,0,0|0,0,1]=2 2 B10R1.17 CNCCC1=CC=CC=N1 HMDB0015644 [0,1,0,0,0,0|2,0,1]=4 3 B10R1.17 NNCCC1=CC=CC=C1 HMDB0014918 [0,1,0,0,0,0|1,0,1]=3 4 B10R1.17 O=COCC1=CC=CC=C1 HMDB0041485 [0,1,0,0,0,0|0,0,0]=1 5 B10R1.18 CC(N)CC1=CC=CC=C1 HMDB0014328 [0,1,0,0,0,0|1,0,1]=3 6 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 HMDB0012128 [0,1,0,0,0,0|1,0,1]=3 7 B10R1.18 C[C@H](N)CC1=CC=CC=C1 HMDB0015516 [0,1,0,0,0,0|1,0,1]=3 8 B10R1.18 OC(=O)CC1=CC=CC=N1 HMDB0060722 [0,1,0,0,0,0|1,0,0]=2 9 B10R2.7 O1C=CC2=C1C=CC=C2 HMDB0032929 [0,0,0,1,0,0|0,0,2]=3 10 B9R1.6 CC(=O)C1=CC=CC=C1 HMDB0033910 [1,1,0,0,0,0|0,0,0]=2 11 B9R1.6 NC(=O)C1=NC=CN=C1 HMDB0014483 [1,1,0,0,0,0|2,0,0]=4 12 B9R1.6 OC(=O)C1=CC=NC=C1 HMDB0060665 [1,1,0,0,0,0|1,0,0]=3 13 B9R1.6 OC(=O)C1=CN=CC=C1 HMDB0001488 [1,1,0,0,0,0|1,0,0]=3 14 B9R1.6 OC(=O)C1=CN=CC=N1 HMDB0059734 [1,1,0,0,0,0|2,0,0]=4 15 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 HMDB0060946 [0,2,0,0,0,0|1,0,0]=3 16 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HMDB0001859 [0,2,0,0,0,0|1,0,0]=3 17 B11R1.20 CC(N)CC1=CC=C(O)C=C1 HMDB0060765 [0,2,0,0,0,0|1,0,1]=4 18 B11R1.192 NCCC1=CC(=O)C(=O)C=C1 HMDB0012219 [0,2,0,0,0,0|1,0,1]=4 19 B11R1.36 C[C@@H](N)[C@@H](O)C1=CC=CC=C1 HMDB0001942 [0,2,0,0,0,0|1,0,1]=4 20 B11R1.40 CN[C@@H](C)CC1=CC=CC=C1 HMDB0015517 [0,2,0,0,0,0|1,0,1]=4 21 B11R1.91 OC(=O)C#CC1=CC=CC=C1 HMDB0002359 [0,2,0,0,0,0|0,0,1]=3 22 B11R1.91 OC(=O)CCC1=CC=CC=C1 HMDB0000764 [0,2,0,0,0,0|0,0,0]=2 23 B11R1.509 CC(C)(N)CC1=CC=CC=C1 HMDB0014337 [0,2,0,0,0,0|1,0,1]=4 24 B11R2.20 C1=CC=C2C=NC=CC2=C1 HMDB0034244 [0,1,0,1,0,0|1,0,1]=4 25 B11R2.4 N[C@@H]1CC1C2=CC=CC=C2 HMDB0014890 [0,1,0,1,0,0|1,0,1]=4