0 B11R1.40 NOC(=O)NC1=CC=CC=C1 DB04157 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.17 C=CCNC1=CC=CC=C1 DB02870 [1,0,0,0,0,0|2,0,1]=4 2 B10R1.17 O=CNCC1=CC=CC=C1 DB02481 [1,0,0,0,0,0|1,0,1]=3 3 B10R1.17 O=COCC1=CC=CC=C1 DB04569 [1,0,0,0,0,0|1,0,1]=3 4 B10R1.17 O=C\C=C\C1=CC=CC=C1 DB14184 [1,0,0,0,0,0|0,0,0]=1 5 B10R1.17 OC\C=C\C1=CC=CC=C1 DB14186 [1,0,0,0,0,0|0,0,2]=3 6 B10R1.18 NC(=S)NC1=CC=CC=C1 DB03694 [1,0,0,0,0,0|2,1,0]=4 7 B12R1.34 [C@H](C)(C1=CC=CC=C1)N(C)C=O DB04379 [0,1,0,0,0,0|1,0,1]=3 8 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O DB02556 [0,1,0,0,0,0|1,0,2]=4 9 B12R1.43 N\C(=C/C1=CC=CC=C1)C(=O)O DB04584 [0,1,0,0,0,0|1,0,0]=2 10 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 DB03884 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.43 [C@H](C)(CC1=CC=CC=C1)C(=O)O DB07673 [0,1,0,0,0,0|0,0,2]=3 12 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(N)=O DB04029 [0,1,0,0,0,0|1,0,2]=4 13 B12R1.43 [C@H](O)(CC1=CC=CC=C1)C(=O)O DB02494 [0,1,0,0,0,0|1,0,2]=4 14 B12R1.49 [C@@H](N)(C=O)CC1=CC=C(O)C=C1 DB03978 [0,1,0,0,0,0|1,0,2]=4 15 B12R2.18 O=C1NC2=CC=CC=C2C1=O DB02095 [0,0,0,1,0,0|2,0,0]=3 16 B12R2.24 O=C1C=CC2=CC=CC=C2N1 DB04745 [0,0,0,1,0,0|3,0,0]=4 17 B12R2.24 O=C1C=CC2=CC=CC=C2O1 DB04665 [0,0,0,1,0,0|3,0,0]=4 18 B10R1.15 O=C(NO)C1=CC=CC=C1 DB01924 [0,0,0,0,1,0|2,0,1]=4 19 B9R1.8 O=CCC1=CC=CC=C1 DB02178 [2,0,0,0,0,0|0,0,1]=3 20 B11R1.91 O=C(O)CCC1=CC=CC=C1 DB02024 [1,1,0,0,0,0|0,0,2]=4 21 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 DB02279 [1,1,0,0,0,0|1,0,0]=3 22 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 DB03357 [1,1,0,0,0,0|1,0,1]=4 23 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 DB02280 [1,1,0,0,0,0|1,0,1]=4 24 B13R1.133 C(C1=CC=C([O-])C=C1)=C(/F)C(=O)O DB02384 [0,2,0,0,0,0|1,0,0]=3 25 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 DB07718 [0,2,0,0,0,0|1,0,1]=4 26 B13R1.202 [C@@H](C)(CC1=CC=CC=C1O)C(=O)O DB01662 [0,2,0,0,0,0|0,0,2]=4 27 B13R1.418 [C@@H](CI)(CC1=CC=CC=C1)C(=O)O DB03441 [0,2,0,0,0,0|0,0,2]=4 28 B13R1.418 [C@H](CS)(CC1=CC=CC=C1)C(=O)O DB02953 [0,2,0,0,0,0|0,0,2]=4 29 B11R1.13 C=CCC1=C(O)C(C)=CC=C1 DB03301 [0,0,1,1,0,0|0,0,2]=4 30 B11R2.20 C1=CC=C2C=NC=CC2=C1 DB04329 [1,0,0,1,0,0|2,0,0]=4 31 B13R2.32 OC1=CC=C2C=CC=CC2=C1O DB07610 [0,0,0,1,0,1|1,0,1]=4 32 B13R2.328 NC1=NC2=CC=CC=C2C(=O)N1 DB03780 [0,1,0,1,0,0|2,0,0]=4 33 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 DB11593 [0,1,0,1,0,0|2,0,0]=4 34 B13R2.435 NC(=[NH2+])C1=CC2=C(C=CC=C2)S1 DB04446 [0,1,0,1,0,0|2,0,0]=4 35 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 DB03028 [0,1,0,1,0,0|2,0,0]=4 36 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 DB07661 [0,1,0,1,0,0|2,0,0]=4 37 B9R1.6 CC(=O)C1=CC=CC=C1 DB04619 [1,0,0,0,1,0|0,0,0]=2 38 B9R1.6 C[C@@H](O)C1=CC=CC=C1 DB04784 [1,0,0,0,1,0|0,0,2]=4 39 B9R1.6 NC(=[NH2+])C1=CC=CC=C1 DB03127 [1,0,0,0,1,0|2,0,0]=4 40 B9R1.6 O=[S@](O)C1=CC=CC=C1 DB03848 [1,0,0,0,1,0|2,0,0]=4