0 B10R1.18 CC(N)CC1=CC=CC=C1 DB00182 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 C[C@H](N)CC1=CC=CC=C1 DB01576 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.18 OC(=O)CC1=CC=CC=C1 DB09269 [0,0,0,0,0,0|0,0,0]=0 3 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 DB00316 [0,1,0,0,0,0|2,0,0]=3 4 B11R1.40 CN[C@@H](C)CC1=CC=CC=C1 DB01577 [0,1,0,0,0,0|2,0,1]=4 5 B11R1.509 CC(C)(N)CC1=CC=CC=C1 DB00191 [0,1,0,0,0,0|2,0,1]=4 6 B11R2.4 N[C@@H]1CC1C2=CC=CC=C2 DB00752 [0,0,0,1,0,0|2,0,1]=4 7 B9R1.6 NC(=O)C1=CC=CN=C1 DB02701 [0,0,0,0,1,0|2,0,0]=3 8 B9R1.6 NC(=O)C1=NC=CN=C1 DB00339 [0,0,0,0,1,0|3,0,0]=4 9 B9R1.6 OC(=O)C1=CC=CC=C1 DB03793 [0,0,0,0,1,0|0,0,0]=1 10 B9R1.6 OC(=O)C1=CN=CC=C1 DB00627 [0,0,0,0,1,0|1,0,0]=2 11 B8R1.2 OCC1=CC=CC=C1 DB06770 [2,0,0,0,0,0|0,0,0]=2 12 B10R1.17 NNCCC1=CC=CC=C1 DB00780 [1,1,0,0,0,0|1,0,1]=4 13 B10R1.61 NC(=O)C1=CC=CC=C1O DB08797 [0,1,0,0,1,0|1,0,0]=3 14 B10R1.61 OC(=O)C1=CC=CC=C1O DB00936 [0,1,0,0,1,0|0,0,0]=2 15 B10R1.61 OC1=CC=CC=C1C([O-])=O DB01397 [0,1,0,0,1,0|0,0,1]=3 16 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)=O DB00120 [0,1,0,0,0,1|0,0,0]=2 17 B12R2.606 ClC1=CC2=C(OC(=O)N2)C=C1 DB00356 [0,1,0,1,0,0|1,0,0]=3 18 B12R1.252 [O-]C(=O)CCCC1=CC=CC=C1 DB06819 [0,0,0,0,0,2|0,0,1]=3