0 B12R1.308 CCNC(=O)C1=C(N)N=CC=C1 AJ-333/25006105 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.308 CCNC(=O)C1=CC=CC=C1N AQ-360/43171950 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.308 CCOC(=O)C1=C(N)C=CC=N1 AF-807/00322012 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.308 CCOC(=O)C1=CN=CC=C1O AC-907/25004796 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.16 CCOC(=O)C1=CN=CN=C1 AN-584/41417189 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.16 N#CCC(=O)C1=CC=CC=C1 AC-907/25014239 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.16 NCCC(=O)C1=CC=CC=C1 AQ-917/42754038 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.16 O=C(SCO)C1=CC=CC=C1 AG-826/25038008 [1,0,0,0,0,0|1,1,0]=3 8 B11R1.222 CNC(=O)C1=C(C)C=CC=C1 AP-065/40324499 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.222 CNC(=O)C1=CC=CC=C1N AQ-360/40271990 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.222 COC(=O)C1=C(I)C=CC=N1 AJ-333/25022047 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.222 COC(=O)C1=C(N)N=CC=N1 AB-323/25048520 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.222 COC(=O)C1=C(O)C=CC=N1 AJ-333/25006091 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.222 COC(=O)C1=C(S)N=CC=C1 AJ-333/25022067 [1,0,0,0,0,0|1,1,0]=3 14 B11R1.222 COC(=O)C1=CC=CN=C1Cl AN-584/42206200 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.222 COC(=O)C1=CC=CNC1=O AJ-333/25006055 [1,0,0,0,0,0|1,0,1]=3 16 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 AE-842/31980017 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.222 NNC(=O)C1=CC=CC=C1N AC-907/25014182 [1,0,0,0,0,0|3,0,0]=4 18 B13R1.12 CC1=C(O)C(C(=O)CCCl)=CC=C1 AO-800/41069760 [0,1,0,0,0,0|2,0,0]=3 19 B13R1.201 CC(C)NC(=O)C1=C(Cl)N=CC=C1 AJ-333/36116055 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.1511 CCOC(=O)C1=C(Cl)C=C(Cl)N=C1 AC-907/25004777 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.1511 CCOC(=O)C1=C(N)NC(=O)N=C1 AG-690/36163001 [0,1,0,0,0,0|3,0,0]=4 22 B13R1.1511 CCOC(=O)C1=C(N)NC(=S)N=C1 AN-584/40148165 [0,1,0,0,0,0|3,0,0]=4 23 B13R1.1511 CCOC(=O)C1=C(O)C=C(O)N=C1 AC-907/34126052 [0,1,0,0,0,0|1,0,0]=2 24 B13R2.328 CC1=CC2=C(C=CC=C2)C(=O)N1 AG-777/40171120 [0,0,0,1,0,0|2,0,1]=4 25 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)O1 AJ-333/25006179 [0,0,0,1,0,0|2,0,1]=4 26 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 AE-641/30105041 [0,0,0,1,0,0|2,0,1]=4 27 B11R1.199 CCOC(=O)C1=C(N)NN=C1 AE-562/40195503 [0,0,0,0,1,0|3,0,0]=4 28 B13R1.470 CCOC(=O)CN1C=CC=CC1=O AE-641/00175010 [0,0,0,0,0,1|1,0,1]=3 29 B13R1.470 CCOC(=O)C[N+]1=CC=CC=C1C AC-907/30063027 [0,0,0,0,0,1|2,0,0]=3 30 B10R1.15 CNC(=O)C1=CC=CC=C1 AP-065/40250235 [2,0,0,0,0,0|1,0,0]=3 31 B10R1.15 COC(=O)C1=CC=NC=N1 AC-907/25004532 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.15 COC(=O)C1=CN=CC=C1 AC-907/25014170 [2,0,0,0,0,0|1,0,0]=3 33 B10R1.15 COC(=O)C1=CN=CC=N1 AN-652/40184635 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.15 COC(=O)C1=CN=CN=C1 AN-584/41341491 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.15 COC(=O)C1=NC=CC=N1 AI-942/25121077 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.15 O=C(CBr)C1=CC=CC=C1 AC-907/25014200 [2,0,0,0,0,0|1,0,0]=3 37 B10R1.15 O=C(CBr)C1=CC=CC=N1 AM-866/25016009 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.4 CCOC1=C(Br)C=CC=N1 AC-907/25004665 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.4 CCOC1=C(N)N=CC=C1 AF-807/00322014 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.4 CCOC1=NC=CC=C1Cl AN-584/42206191 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.61 CC1=C(C(=O)O)C=CC=C1 AB-131/40195545 [2,0,0,0,0,0|1,0,0]=3 42 B10R1.61 CC1=C(C(N)=O)C=CC=C1 AE-508/40403814 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.61 CC1=NC=CC=C1C(=O)O AO-801/41077423 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.61 CN(C)C1=CC=CC=C1O AE-562/43286985 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.61 NC(=O)C1=C(O)C=CC=C1 AH-034/32461056 [2,0,0,0,0,0|1,0,0]=3 46 B10R1.61 NC(=O)C1=CC=CC=C1Cl AJ-333/25022002 [2,0,0,0,0,0|2,0,0]=4 47 B10R1.61 NC1=C(C(=O)O)C=CC=N1 AC-907/25014115 [2,0,0,0,0,0|2,0,0]=4 48 B10R1.61 NC1=C(C(=O)O)N=CC=C1 AF-807/00322011 [2,0,0,0,0,0|2,0,0]=4 49 B10R1.61 NC1=CC=NC=C1C(=O)O AF-807/00322021 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.61 NC1=CN=CC=C1C(=O)O AC-907/25000242 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 AE-641/00396046 [2,0,0,0,0,0|1,0,0]=3 52 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 AC-907/30003052 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 AB-131/40168737 [2,0,0,0,0,0|1,0,0]=3 54 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 AC-907/34123052 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 AC-907/30003060 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.61 O=C(O)C1=C(I)C=CC=C1 AA-506/30136037 [2,0,0,0,0,0|1,0,0]=3 57 B10R1.61 O=C(O)C1=C(O)C=CC=N1 AC-907/25014108 [2,0,0,0,0,0|1,0,0]=3 58 B10R1.61 O=C(O)C1=C(O)N=CC=C1 AI-942/25034173 [2,0,0,0,0,0|1,0,0]=3 59 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AI-204/31702063 [2,0,0,0,0,0|1,1,0]=4 60 B10R1.61 O=C(O)C1=CC=CC=[N+]1[O-] AC-907/25014369 [2,0,0,0,0,0|1,0,1]=4 61 B10R1.61 O=C(O)C1=CC=CN=C1F AI-942/25034137 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.61 O=C(O)C1=CC=COC1=O AI-942/25121066 [2,0,0,0,0,0|1,0,1]=4 63 B10R1.61 O=C(O)C1=CC=NC=C1Br AC-907/30003054 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.61 O=C(O)C1=CC=NC=C1Cl AC-907/34116064 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.61 O=C(O)C1=CC=NC=C1I AC-907/30003058 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.61 O=C(O)C1=CC=NC=C1O AC-907/25004511 [2,0,0,0,0,0|1,0,0]=3 67 B10R1.61 O=C(O)C1=CN=CC=C1Cl AF-399/40245588 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.61 O=C(O)C1=CN=CC=C1S AJ-333/25022011 [2,0,0,0,0,0|1,1,0]=4 69 B10R1.61 O=C(O)C1=NC=CC=C1Br AF-399/40963066 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.61 O=C([O-])C1=C(O)C=CN=C1 AC-907/25004513 [2,0,0,0,0,0|1,0,1]=4 71 B10R1.61 O=C([O-])C1=C(O)N=CC=C1 AC-907/25004510 [2,0,0,0,0,0|1,0,1]=4 72 B10R1.61 O=C([O-])C1=CC=CC=C1Cl AE-477/25037013 [2,0,0,0,0,0|1,0,1]=4 73 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 AB-131/40228446 [2,0,0,0,0,0|1,0,1]=4 74 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 AE-562/40377256 [1,1,0,0,0,0|0,0,0]=2 75 B12R1.16 CCOC(=O)C1=CNC(=O)C=C1 AP-402/41884914 [1,1,0,0,0,0|1,0,0]=3 76 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 AN-584/40247085 [1,1,0,0,0,0|0,0,0]=2 77 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 AE-562/40233260 [1,1,0,0,0,0|0,0,0]=2 78 B12R1.17 CCOC(=O)C1=CN=CC(O)=C1 AJ-333/25022004 [1,1,0,0,0,0|1,0,0]=3 79 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 AP-782/40197370 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.125 CC(=O)\C=C\C1=C(O)C=CC=C1 AO-840/40184794 [1,1,0,0,0,0|1,0,1]=4 81 B12R1.24 O=C(CCl)C1=CC=CC(O)=C1O AE-562/43458977 [1,1,0,0,0,0|1,0,0]=3 82 B12R1.77 COC(=O)C1=C(OC)C=CC=C1 AE-562/40238261 [1,1,0,0,0,0|0,0,0]=2 83 B12R1.77 COC(=O)C1=C(SC)N=CC=C1 AJ-333/25006178 [1,1,0,0,0,0|1,1,0]=4 84 B12R1.354 COC(=O)C1=C(N)C=CC(O)=C1 AN-584/43164258 [1,1,0,0,0,0|1,0,0]=3 85 B12R1.354 COC(=O)C1=C(O)C=CC(Cl)=C1 AN-652/43414006 [1,1,0,0,0,0|0,0,0]=2 86 B12R1.354 COC(=O)C1=C(O)C=CC(N)=C1 AB-131/42300689 [1,1,0,0,0,0|0,0,0]=2 87 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O AG-205/05818032 [1,1,0,0,0,0|0,0,0]=2 88 B12R1.1703 CCC(=O)C1=CC=C(O)C=C1O AE-562/40724473 [1,1,0,0,0,0|0,0,0]=2 89 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Cl AN-584/43393256 [1,1,0,0,0,0|1,0,0]=3 90 B12R1.1703 COC(=O)C1=CC=C(O)C=C1C AE-562/43459973 [1,1,0,0,0,0|1,0,0]=3 91 B12R1.1703 COC(=O)C1=CC=[N+](C)C=C1Br AJ-333/25022034 [1,1,0,0,0,0|2,0,0]=4 92 B12R1.1703 COC(=O)C1=CC=[N+](C)C=C1[S-] AJ-333/25022036 [1,1,0,0,0,0|1,1,0]=4 93 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(Cl)C=C1 AN-907/25060018 [1,1,0,0,0,0|2,0,0]=4 94 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1Br AC-907/25004764 [1,1,0,0,0,0|1,0,0]=3 95 B12R1.313 CCOC(=O)C1=C(C)NC(C)=C1 AI-942/25034694 [0,1,0,0,1,0|2,0,0]=4 96 B12R1.1589 CCOC(=O)C1=C(C)SC=C1O AG-219/04450034 [0,1,0,0,1,0|1,0,0]=3 97 B14R1.965 CCOC(=O)CC1=CC=CC=C1C#N AN-584/42206212 [0,1,0,0,0,1|1,0,0]=3 98 B14R1.7265 CCOC(=O)C1=C(O)C(Cl)=C(O)N=C1 AC-907/25004787 [0,2,0,0,0,0|1,0,0]=3 99 B14R1.6048 CC(C)CC(=O)C1=CC=C(O)C=C1O AK-087/40724414 [0,2,0,0,0,0|1,0,0]=3 100 B14R1.1035 CC1=CC=CC=C1C(=O)NCCCCl AG-690/11635236 [0,2,0,0,0,0|2,0,0]=4 101 B14R1.7234 CCOC(=O)C1=CC=C(OC)C=C1N AE-562/43287040 [0,2,0,0,0,0|1,0,0]=3 102 B14R1.18811 CCOC(=O)C1=C(C)N=C(N)C=C1O AE-406/41056166 [0,2,0,0,0,0|1,0,0]=3 103 B14R1.18811 COCC(=O)C1=C(O)C=C(O)C=C1O AQ-358/40710279 [0,2,0,0,0,0|2,0,0]=4 104 B12R1.32 CCOC(=O)NC1=NC=CC=C1 AC-907/25004804 [0,0,1,1,0,0|2,0,0]=4 105 B12R2.1081 O=C1CCC[N+]2=C1C=CC=C2 AQ-405/42300548 [1,0,0,1,0,0|2,0,0]=4 106 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AB-131/40347218 [1,0,0,1,0,0|2,0,0]=4 107 B12R2.203 CC1=CC=CC2=C1C(=O)OC2 AB-016/41252626 [1,0,0,1,0,0|1,0,0]=3 108 B14R2.215 CCN1C(=O)C2=C(C=CC=C2)C1=O AG-455/02685023 [0,1,0,1,0,0|1,0,1]=4 109 B14R2.1019 CCC1=NC2=C(C=CC=C2)C(=O)N1 AE-848/33831006 [0,1,0,1,0,0|2,0,0]=4 110 B14R2.1019 O=C1C=C(CO)OC2=C1C=CC=C2 AK-928/14102004 [0,1,0,1,0,0|1,0,1]=4 111 B14R2.8719 O=C1CCCCC2=C1C=CC(O)=C2 AN-584/43301428 [0,1,0,1,0,0|2,0,0]=4 112 B10R1.149 COC(=O)C1=C(Br)C=CS1 AN-584/43414011 [1,0,0,0,1,0|2,0,0]=4 113 B10R1.149 COC(=O)C1=C(N)SC=C1 AI-942/25034264 [1,0,0,0,1,0|2,0,0]=4 114 B10R1.149 COC(=O)C1=C(O)C=CS1 AB-337/25021053 [1,0,0,0,1,0|1,0,0]=3 115 B10R1.149 COC(=O)C1=CSC=C1Br AI-942/25034165 [1,0,0,0,1,0|2,0,0]=4