0 B10R1.59 CC(=O)C1=C(Br)C=C(Br)S1 AI-942/42301929 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.59 CC(=O)C1=C(C)N=C(N)S1 AF-886/31411029 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.59 CC(=O)C1=C(C)NC(C)=C1 AG-777/40171145 [0,0,0,0,0,0|1,0,1]=2 3 B10R1.59 CC1=C([N+](=O)[O-])SC(Br)=C1 AI-942/13331007 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.59 CC1=C([N+](=O)[O-])SC(N)=N1 AB-601/30915007 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.59 CC1=CC(C(=O)O)=C(C)S1 AK-830/25033038 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.59 CC1=CC(C(=O)O)=C(C)[Se]1 AI-942/25034445 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.22 CC1=CC(C=O)=C(C)N1 AA-516/30054053 [1,0,0,0,0,0|1,0,1]=3 8 B9R1.35 CC(=O)C1=CC=C(Br)S1 AI-942/25034161 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.35 CC(=O)C1=CC=C(Cl)S1 AI-942/40232791 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.35 CC1=CC=C(C(=O)O)S1 AI-942/25034216 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.41 CC(=O)C1=C(I)C=CS1 AI-942/25034172 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.41 CC1=C(C(=O)O)C=CO1 AK-830/25033015 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.41 CC1=C(C(=O)O)C=CS1 AI-942/25034218 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.41 CC1=C(C(=O)O)OC=C1 AB-337/25021043 [1,0,0,0,0,0|2,1,0]=4 15 B9R1.41 O=C(O)C1=C(Br)C=CS1 AF-960/00468043 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.41 O=C(O)C1=C(F)C=CS1 AI-942/25121036 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.50 CSC1=NC(N)=C(C(C)=O)S1 AA-516/25012131 [0,1,0,0,0,0|1,0,0]=2 18 B11R1.225 CC1=CC(\C(C)=N\O)=C(C)O1 AO-800/41069711 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 AG-670/25010006 [0,1,0,0,0,0|1,0,0]=2 20 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 AI-942/25034463 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.225 C\N=C(\C)C1=C(C)NC(C)=C1 AG-777/25006447 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.673 CC1=C(C)C(C(=O)O)=C(C)O1 AE-562/43287004 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.673 CC1=C(I)C(C(=O)O)=C(C)S1 AI-942/25034408 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Cl AG-664/25098010 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 AB-131/40207591 [0,0,0,0,0,1|3,0,0]=4 26 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 AE-562/40207817 [0,0,0,0,0,1|3,0,0]=4 27 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 AC-907/25004794 [0,0,0,0,0,1|3,0,0]=4 28 B11R1.166 CC1=CC(C)=C(C(N)=O)C=N1 AC-907/34120009 [0,0,0,0,0,1|3,0,0]=4 29 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 AP-501/43363579 [0,0,0,0,0,1|2,0,0]=3 30 B11R1.166 CC1=NC(C)=C([N+](=O)[O-])C=C1 AC-907/25004680 [0,0,0,0,0,1|3,0,0]=4 31 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 AE-562/43387288 [0,0,0,0,0,1|3,0,0]=4 32 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 AF-399/25053009 [0,0,0,0,0,1|1,0,0]=2 33 B11R1.645 CC1=NC(C)=C(CC(N)=O)S1 AF-399/25053008 [0,0,0,0,0,1|1,0,0]=2 34 B8R1.11 O=CC1=C(I)C=CS1 AI-942/25121040 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.18 CC1=C(C)SC(=S)N1 AB-601/30915016 [2,0,0,0,0,0|1,0,1]=4 36 B8R1.7 CC(=O)C1=CC=CN1 AI-942/25034253 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.7 CC(=O)C1=COC=C1 AI-942/25034202 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.7 CC(=O)C1=CSC=C1 AI-942/40192066 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.7 CC(=O)C1=C[Se]C=C1 AI-942/25034210 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.34 CC1=C(C)C(I)=C(C=O)S1 AI-942/25034406 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.34 CC1=C(C=O)SC(Br)=C1Br AI-942/25034614 [1,1,0,0,0,0|2,0,0]=4 42 B10R1.34 CC1=CC(C=O)=C(C)N1C AN-967/25120036 [1,1,0,0,0,0|1,0,1]=4 43 B10R1.256 CC1=C(I)C(C=O)=C(C)S1 AI-942/25034407 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.14 COC(=O)C1=CC(C)=NO1 AN-970/40211557 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.31 CCC1=CC=C(C(=O)O)S1 AI-942/25034437 [1,1,0,0,0,0|2,0,0]=4 46 B10R1.31 COC1=CC=C(C(=O)O)S1 AI-942/25121080 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 AI-942/25034163 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 AI-942/25034428 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.149 COC(=O)C1=C(Br)C=CS1 AN-584/43414011 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.149 COC(=O)C1=C(C)N=CS1 AN-970/40920407 [1,1,0,0,0,0|0,0,0]=2 51 B10R1.149 COC(=O)C1=C(O)C=CS1 AB-337/25021053 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.358 COC(=O)C1=NC(N)=NC(C)=C1 AG-664/25005970 [0,1,0,0,0,1|2,0,0]=4 53 B12R1.232 CC(=O)C1=CC(N)=C(C)C=C1C AE-562/43458993 [0,1,0,0,0,1|2,0,0]=4 54 B12R1.65 CC(=O)NC1=C(C#N)C=C(C)S1 AA-516/30040037 [0,1,0,0,0,1|1,0,1]=4 55 B12R1.313 CCOC(=O)C1=C(C)N=C(N)S1 AB-601/30963021 [0,2,0,0,0,0|1,0,0]=3 56 B12R1.313 CCOC(=O)C1=C(C)NC(C)=C1 AI-942/25034694 [0,2,0,0,0,0|1,0,1]=4 57 B12R1.3443 COC(=O)C1=C(C)SC(C)=C1I AI-942/25034560 [0,2,0,0,0,0|2,0,0]=4 58 B12R1.101 CC(=O)NC1=CC(C)=CC(C)=C1 AE-562/40299623 [0,0,0,0,0,2|2,0,0]=4 59 B12R1.101 CC(=O)NC1=CC(C)=NC(C)=N1 AI-942/40920417 [0,0,0,0,0,2|1,0,0]=3