0 B10R1.27 N[C@@H](CO)CC1=CNC=N1 P36246 [0,0,0,0,0,0|0,0,4]=4 1 B10R1.27 N[C@H](CO)CC1=CNC=N1 P40873 [0,0,0,0,0,0|0,0,4]=4 2 B9R1.13 CC(C)SC1=CN=CN1 O32082 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.35 NC(CC1=CNN=C1)C(=O)O Q57381 [0,1,0,0,0,0|2,0,0]=3 4 B11R1.35 NC(CC1=CNN=C1)C(=O)O Q57382 [0,1,0,0,0,0|2,0,0]=3 5 B11R1.35 NC(CC1=CSC=C1)C(=O)O O27897 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.35 NC(CC1=CSC=N1)C(=O)O P41158 [0,1,0,0,0,0|1,0,1]=3 7 B11R1.35 NC(CN1C=CC=N1)C(=O)O P39090 [0,1,0,0,0,0|2,0,1]=4 8 B11R1.35 NC(CN1C=NC=N1)C(=O)O P42563 [0,1,0,0,0,0|1,0,1]=3 9 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O O28616 [0,1,0,0,0,0|2,0,0]=3 10 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O O28900 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O O28846 [0,1,0,0,0,0|1,0,1]=3 12 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O O28615 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O O28680 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O O28617 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O O28904 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.35 O=C(O)[C@H](O)CC1=CC=CS1 P35098 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 P51547 [0,0,0,0,0,1|3,0,0]=4 18 B8R1.8 N#CCC1=CN=CN1 G-5552 [2,0,0,0,0,0|0,0,2]=4 19 B8R1.8 NCCC1=CC=CO1 O34064 [2,0,0,0,0,0|2,0,0]=4 20 B8R1.8 NCCC1=CSC=C1 G-7583 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.8 NCCC1=NN=CS1 G-7856 [2,0,0,0,0,0|2,0,0]=4 22 B8R1.8 NCCN1C=CN=C1 O32262 [2,0,0,0,0,0|2,0,0]=4 23 B8R1.8 NCCN1C=CN=C1 P37320 [2,0,0,0,0,0|2,0,0]=4 24 B8R1.8 NCCN1C=NC=N1 L20140 [2,0,0,0,0,0|1,0,1]=4 25 B8R1.8 OCCC1=CN=CN1 G-7568 [2,0,0,0,0,0|0,0,1]=3 26 B10R1.66 O=C(O)CCC1=CNC=N1 O30645 [1,1,0,0,0,0|0,0,2]=4 27 B10R1.66 O=C(O)CCC1=CNN=C1 Q60485 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.66 O=C(O)CCC1=CSC=C1 P40765 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.66 O=C(O)CCN1C=CN=C1 P40203 [1,1,0,0,0,0|2,0,0]=4 30 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O P43046 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Q60576 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.43 CC(CC1=NC=NC=C1)C(=O)O Q60710 [0,1,0,0,0,1|1,0,1]=4 33 B12R1.43 NC(CC1=CN=CN=C1)C(=O)O Q63780 [0,1,0,0,0,1|0,0,1]=3 34 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P36885 [0,1,0,0,0,1|1,0,0]=3 35 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P43169 [0,1,0,0,0,1|1,0,0]=3 36 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O P38459 [0,1,0,0,0,1|1,0,0]=3 37 B12R1.43 N[C@@H](CC1=CN=CN=C1)C(=O)O Q63782 [0,1,0,0,0,1|0,0,1]=3 38 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O P38458 [0,1,0,0,0,1|1,0,1]=4 39 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O P36517 [0,1,0,0,0,1|1,0,0]=3 40 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O O27942 [0,1,0,0,0,1|1,0,0]=3 41 B12R1.43 N[C@H](CC1=CN=CN=C1)C(=O)O Q63781 [0,1,0,0,0,1|0,0,1]=3 42 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O P38457 [0,1,0,0,0,1|1,0,1]=4 43 B12R1.104 CN1C=C(CC(N)C(=O)O)C=N1 Q63774 [0,2,0,0,0,0|2,0,0]=4 44 B12R1.104 CN1C=C(C[C@@H](N)C(=O)O)C=N1 Q63775 [0,2,0,0,0,0|2,0,0]=4 45 B12R1.104 CN1C=C(C[C@H](N)C(=O)O)C=N1 Q63776 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.104 NC(CC1=CC=C(Br)S1)C(=O)O P37150 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.104 NC(CC1=CC=C(Cl)S1)C(=O)O O28665 [0,2,0,0,0,0|2,0,0]=4 48 B12R1.104 N[C@@H](CC1=CC(Br)=CS1)C(=O)O O28746 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.104 N[C@@H](CC1=CC=C(Br)S1)C(=O)O O28860 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.104 N[C@@H](CC1=CC=C(Cl)S1)C(=O)O O28487 [0,2,0,0,0,0|2,0,0]=4 51 B12R1.104 N[C@H](CC1=CC=C(Br)S1)C(=O)O O28780 [0,2,0,0,0,0|2,0,0]=4 52 B12R1.145 CC1=C(CC(N)C(=O)O)SC=C1 O28664 [0,2,0,0,0,0|2,0,0]=4 53 B12R1.145 CC1=C(C[C@H](N)C(=O)O)SC=C1 O28484 [0,2,0,0,0,0|2,0,0]=4 54 B8R1.7 C[C@H](N)C1=CN=CO1 L19494 [1,0,0,0,1,0|1,0,1]=4 55 B8R1.7 NC(=O)C1=CC=CN1 P38018 [1,0,0,0,1,0|1,0,1]=4 56 B8R1.7 NC(=O)C1=CN=CO1 O31664 [1,0,0,0,1,0|1,0,1]=4 57 B8R1.7 NC(=O)C1=CN=CS1 O30585 [1,0,0,0,1,0|1,0,1]=4 58 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [1,0,0,0,0,1|1,0,0]=3