0 B9R1.35 CC1=CC=C(C(=O)O)S1 AI-942/25034216 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 CC1=CSC(C(=O)O)=C1 AI-942/25034215 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.35 O=C(O)C1=CC(Br)=CS1 AF-960/00468042 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 O=C(O)C1=CC=C(Br)O1 AE-641/00180017 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 O=C(O)C1=CSC(Br)=C1 AR-362/33754020 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.35 O=C(O)C1=CSC(Cl)=C1 AI-942/25121028 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 O=C1NC=C(C(=O)O)N1 AO-080/40387978 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.7 CC(=O)C1=CC=CN1 AI-942/25034253 [1,0,0,0,0,0|2,0,1]=4 8 B8R1.7 CC(=O)C1=COC=C1 AI-942/25034202 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.7 CC(=O)C1=CSC=C1 AI-942/40192066 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.7 CC(=O)C1=C[Se]C=C1 AI-942/25034210 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.7 O=C(O)C1=CC=CN1 AC-907/25014066 [1,0,0,0,0,0|1,0,1]=3 12 B8R1.7 O=C(O)C1=CC=CO1 AC-907/25014051 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.7 O=C(O)C1=CC=C[Se]1 AI-942/25034662 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.7 O=C(O)C1=CSC=N1 AN-604/40744409 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.7 O=C(O)C1=CSN=N1 AE-842/30373016 [1,0,0,0,0,0|1,0,1]=3 16 B8R1.7 O=C(O)C1=NC=CN1 AC-907/34115015 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.14 COC(=O)C1=CC(C)=NO1 AN-970/40211557 [0,1,0,0,0,0|1,0,1]=3 18 B10R1.31 CCC1=CC=C(C(=O)O)S1 AI-942/25034437 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.31 COC1=CC=C(C(=O)O)S1 AI-942/25121080 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.31 O=CC1=CC(C(=O)O)=CS1 AI-942/25034148 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 AI-942/25034163 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 AI-942/25034428 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.59 CC(=O)C1=C(C)NC(C)=C1 AG-777/40171145 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.59 CC1=CC(C(=O)O)=C(C)S1 AK-830/25033038 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.59 CC1=CC(C(=O)O)=C(C)[Se]1 AI-942/25034445 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.194 C=C1C(=O)OC=C1C(=O)O AB-016/41252627 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.194 CC1=C(C(=O)O)N=NN1C AG-205/25006768 [0,1,0,0,0,0|1,0,1]=3 28 B10R1.194 O=C(O)C1=C(I)C(I)=CS1 AI-942/25121019 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.13 CC1=CC=C(C(=O)O)C=C1 AB-131/40170882 [0,0,0,0,0,1|2,0,0]=3 30 B10R1.13 CC1=CC=C([N+](=O)[O-])N=C1 AC-907/25004529 [0,0,0,0,0,1|2,0,1]=4 31 B10R1.13 CC1=CCC(C(=O)O)CN1 AO-801/41077421 [0,0,0,0,0,1|1,0,1]=3 32 B10R1.13 NC1=CN=C(C(=O)O)C=C1 AN-717/40173468 [0,0,0,0,0,1|2,0,0]=3 33 B10R1.13 NC1=NC=C(C(=O)O)C=C1 AI-942/25034199 [0,0,0,0,0,1|2,0,1]=4 34 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 AC-907/25004491 [0,0,0,0,0,1|2,0,0]=3 35 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AE-562/40168810 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.13 O=C(O)C1=CC=C(F)C=C1 AE-562/40177766 [0,0,0,0,0,1|3,0,0]=4 37 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AE-562/42923958 [0,0,0,0,0,1|3,0,0]=4 38 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AE-848/32195059 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.13 O=C(O)C1=CC=C(S)N=C1 AJ-333/25022012 [0,0,0,0,0,1|2,0,1]=4 40 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 AI-942/13331025 [0,0,0,0,0,1|2,0,1]=4 41 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AJ-333/25006089 [0,0,0,0,0,1|2,0,0]=3 42 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 AO-801/41077520 [0,0,0,0,0,1|3,0,0]=4 43 B10R1.113 CC1=CC=CC(C(=O)O)=C1 AB-131/40222909 [0,0,0,0,0,1|2,0,0]=3 44 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AO-801/41077373 [0,0,0,0,0,1|3,0,0]=4 45 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 AC-907/25004677 [0,0,0,0,0,1|3,0,0]=4 46 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 AC-907/30003011 [0,0,0,0,0,1|3,0,0]=4 47 B10R1.113 NC1=CC(C(=O)O)=CC=N1 AH-011/25003862 [0,0,0,0,0,1|2,0,1]=4 48 B10R1.113 NC1=CC(C(=O)O)=CN=C1 AC-907/25005377 [0,0,0,0,0,1|2,0,0]=3 49 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 AQ-344/40293172 [0,0,0,0,0,1|3,0,0]=4 50 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 AF-399/40173400 [0,0,0,0,0,1|2,0,0]=3 51 B10R1.113 O=C(O)C1=CC(F)=CC=C1 AE-562/40187179 [0,0,0,0,0,1|3,0,0]=4 52 B10R1.113 O=C(O)C1=CC(O)=CC=N1 AF-399/40171304 [0,0,0,0,0,1|2,0,0]=3 53 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AE-562/43403710 [0,0,0,0,0,1|3,0,0]=4 54 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AE-562/40227537 [0,0,0,0,0,1|3,0,0]=4 55 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 AC-907/30003053 [0,0,0,0,0,1|2,0,1]=4 56 B10R1.113 O=C(O)C1=CC=NC(Cl)=C1 AN-584/40173345 [0,0,0,0,0,1|2,0,1]=4 57 B10R1.113 O=C(O)C1=CC=NC(S)=C1 AJ-333/25022072 [0,0,0,0,0,1|2,0,1]=4 58 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 AJ-333/25006086 [0,0,0,0,0,1|2,0,0]=3 59 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AE-848/00984004 [0,0,0,0,0,1|2,0,0]=3 60 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AF-399/41061033 [0,0,0,0,0,1|2,0,0]=3 61 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AF-399/41061070 [0,0,0,0,0,1|2,0,0]=3 62 B7R0.4 C\C=C\C=C\C(=O)O AN-651/40229308 [1,0,1,0,0,0|2,0,0]=4 63 B7R1.1 O=CC1=CNC=C1 AC-776/25122024 [2,0,0,0,0,0|1,0,0]=3 64 B7R1.1 O=CC1=CNC=N1 AB-131/25126048 [2,0,0,0,0,0|2,0,0]=4 65 B7R1.2 CC1=CC(C)=NN1 AE-848/32586026 [2,0,0,0,0,0|0,0,1]=3 66 B7R1.2 CC1=NC(O)=NN1 AC-907/25004250 [2,0,0,0,0,0|1,0,0]=3 67 B7R1.2 CC1=NNC(Cl)=C1 AC-907/25004293 [2,0,0,0,0,0|1,0,1]=4 68 B9R1.22 CC1=CC(C=O)=C(C)N1 AA-516/30054053 [1,1,0,0,0,0|1,0,0]=3 69 B9R1.41 CC1=C(C(=O)O)C=CO1 AK-830/25033015 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.41 CC1=C(C(=O)O)C=CS1 AI-942/25034218 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.41 CC1=C(C(=O)O)OC=C1 AB-337/25021043 [1,1,0,0,0,0|2,0,0]=4 72 B9R1.41 CN1C=CC=C1C(=O)O AI-942/25034255 [1,1,0,0,0,0|1,0,1]=4 73 B9R1.41 NC1=NON=C1C(=O)O AG-205/25005621 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.41 O=C(O)C1=C(Br)C=CO1 AI-942/25121026 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.41 O=C(O)C1=C(Br)C=CS1 AF-960/00468043 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.41 O=C(O)C1=C(Cl)C=NN1 AG-664/25027001 [1,1,0,0,0,0|0,0,2]=4 77 B9R1.41 O=C(O)C1=C(F)C=CS1 AI-942/25121036 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.41 O=C(O)C1=C(F)SC=C1 AI-942/25121035 [1,1,0,0,0,0|2,0,0]=4 79 B9R1.41 O=C(O)C1=C(I)C=NN1 AG-690/36538047 [1,1,0,0,0,0|0,0,2]=4 80 B9R1.41 O=[N+]([O-])C1=NNC=C1Cl AK-968/37166378 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 AE-641/00011036 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.3 CCC1=CC=C(C(=O)O)N=C1 AG-690/37166084 [0,1,0,0,0,1|1,0,0]=3 83 B11R1.3 COC1=CC=C(C(=O)O)C=C1 AE-848/32075009 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.3 COC1=CC=C(C(=O)O)N=C1 AE-562/43286910 [0,1,0,0,0,1|1,0,0]=3 85 B11R1.3 CSC1=CC=C(C(=O)O)C=N1 AJ-333/25022080 [0,1,0,0,0,1|1,0,1]=4 86 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 AE-562/40207816 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.21 CC1=CC=C(C(=O)O)C=C1I AN-970/40920439 [0,1,0,0,0,1|2,0,0]=4 88 B11R1.21 CN1C=C(C(=O)O)C=CC1=O AC-907/34118031 [0,1,0,0,0,1|2,0,0]=4 89 B11R1.21 CN1C=C(C(=O)O)C=CC1=S AJ-333/25022081 [0,1,0,0,0,1|2,0,0]=4 90 B11R1.21 O=C(O)C1=CC(O)=C(O)C=N1 AC-907/30003018 [0,1,0,0,0,1|2,0,0]=4 91 B11R1.21 O=C(O)C1=CC=C(O)C(Br)=N1 AR-011/43409547 [0,1,0,0,0,1|2,0,0]=4 92 B11R1.22 COC(=O)C1=CC=C(C)C=C1 AB-131/40218986 [0,1,0,0,0,1|2,0,0]=4 93 B11R1.22 COC(=O)C1=NC=C(F)C=N1 AR-527/43461195 [0,1,0,0,0,1|2,0,0]=4 94 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 AE-562/40207817 [0,1,0,0,0,1|2,0,0]=4 95 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 AC-907/25004794 [0,1,0,0,0,1|1,0,1]=4 96 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 AP-501/43363579 [0,1,0,0,0,1|1,0,1]=4 97 B11R1.166 NC1=NC(=O)NC=C1C(=O)O AN-584/40205761 [0,1,0,0,0,1|2,0,0]=4 98 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=N1 AC-907/30003050 [0,1,0,0,0,1|2,0,0]=4 99 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AQ-405/42300546 [0,1,0,0,0,1|2,0,0]=4 100 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 AB-131/40207591 [0,1,0,0,0,1|2,0,0]=4 101 B11R1.74 CC1=CC(O)=NC(C(=O)O)=C1 AO-801/41077460 [0,1,0,0,0,1|1,0,0]=3 102 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 AB-323/25048164 [0,1,0,0,0,1|1,0,1]=4 103 B11R1.159 CC1=CC=CC(C(=O)O)=C1C AN-584/43413323 [0,1,0,0,0,1|2,0,0]=4 104 B11R1.159 CC1=CC=CC(C(=O)O)=C1N AE-562/40317024 [0,1,0,0,0,1|2,0,0]=4 105 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 AE-562/43387288 [0,1,0,0,0,1|2,0,0]=4 106 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O AJ-333/25022118 [0,1,0,0,0,1|2,0,0]=4 107 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 AF-399/25108076 [0,1,0,0,0,1|1,0,1]=4 108 B11R1.266 CNC1=NC(C(=O)O)=CN=C1 AF-615/00089015 [0,1,0,0,0,1|2,0,0]=4 109 B11R1.266 COC1=CC=CC(C(=O)O)=C1 AE-562/40299919 [0,1,0,0,0,1|2,0,0]=4 110 B11R1.266 COC1=CN=CC(C(=O)O)=N1 AF-615/25002831 [0,1,0,0,0,1|2,0,0]=4 111 B11R1.266 COC1=NC=CC(C(=O)O)=C1 AN-584/43204258 [0,1,0,0,0,1|1,0,1]=4 112 B11R1.266 CSC1=CC=NC(C(=O)O)=C1 AJ-333/25022041 [0,1,0,0,0,1|1,0,0]=3 113 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 AE-562/43286922 [0,1,0,0,0,1|2,0,0]=4 114 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 AC-907/25014203 [0,1,0,0,0,1|2,0,0]=4 115 B11R1.15 CCOC(=O)C1=CC(C)=NN1 AG-664/25003391 [0,2,0,0,0,0|0,0,2]=4 116 B11R1.673 CC1=C(C)C(C(=O)O)=C(C)O1 AE-562/43287004 [0,2,0,0,0,0|2,0,0]=4 117 B11R1.673 CC1=C(I)C(C(=O)O)=C(C)S1 AI-942/25034408 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Cl AG-664/25098010 [0,2,0,0,0,0|0,0,2]=4 119 B9R1.6 O=C(O)C1=CN=CC=N1 AB-131/40186434 [0,0,1,1,0,0|2,0,0]=4 120 B7R0.16 C\C(Br)=C(/C)C(=O)O AI-942/25121055 [0,0,1,0,1,0|2,0,0]=4 121 B9R1.13 O=C(O)CC1=COC=C1 AI-942/25034203 [1,0,0,0,0,1|2,0,0]=4 122 B9R1.13 O=C(O)CC1=CSC=C1 AI-942/25034212 [1,0,0,0,0,1|2,0,0]=4 123 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 AI-942/25034577 [0,0,0,0,0,2|2,0,0]=4 124 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 AC-509/25002068 [0,0,0,0,0,2|2,0,0]=4 125 B11R1.75 CC1=NN=C(SCC(=O)O)N1 AO-365/40208393 [0,0,0,0,0,2|1,0,1]=4 126 B11R1.157 CC(=O)NC1=CC(=O)NC=N1 AB-323/25048063 [0,0,0,0,0,2|2,0,0]=4 127 B11R1.157 CC(=O)NC1=CC(C)=CC=N1 AC-907/25004803 [0,0,0,0,0,2|2,0,0]=4