0 B11R1.182 CC1=CC(NC=O)=C(C)C=C1 AE-861/30098048 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.4 CC1=C(NC=O)C=CC=C1 AB-131/41338123 [1,0,0,0,0,0|2,0,1]=4 2 B10R1.30 CC1=CC=C(O)C(CO)=C1 AE-562/43461492 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.30 CC1=NC(CO)=C(O)C=C1 AJ-333/25022097 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.30 COC1=C(N)C=CC(Br)=C1 AN-584/11607260 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.30 COC1=CC(Cl)=CC=C1N AN-584/43422715 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.30 OCC1=C(I)C=CC(Cl)=C1 AE-641/25069012 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.127 CC1=CC=C(C)C(NC(N)=S)=C1 AM-944/40947447 [0,1,0,0,0,0|1,0,1]=3 8 B12R2.606 CC1=CC2=C(C=C1)N=C(N)S2 AE-641/00127047 [0,0,0,1,0,0|2,0,1]=4 9 B10R1.187 CC1=NNC(C)=C1CCBr AG-690/09405042 [0,0,0,0,1,0|3,0,0]=4 10 B9R1.15 CC1=C(CN)C=CC=C1 AP-770/40653937 [2,0,0,0,0,0|0,0,0]=2 11 B9R1.15 CCC1=C(C)C=CN=C1 AO-801/41077436 [2,0,0,0,0,0|1,0,0]=3 12 B9R1.15 NC1=CC=CC=C1CO AC-907/25014178 [2,0,0,0,0,0|2,0,0]=4 13 B9R1.15 OCC1=C(Cl)C=CC=C1 AC-509/25001981 [2,0,0,0,0,0|2,0,0]=4 14 B9R1.2 NCC1=CC(Br)=CC=C1 AE-562/11384036 [2,0,0,0,0,0|1,0,0]=3 15 B9R1.69 CC1=C(N)C=CC(Br)=C1 AE-562/43306593 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.69 CC1=C(O)C=CC(Br)=C1 AN-329/40925146 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.69 CC1=CC(C)=C(Br)N=C1 AC-907/25004664 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.69 CC1=CC(C)=[N+](C)C=N1 AC-907/25004724 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.69 CC1=CC(I)=CC=C1N AE-641/01196008 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.69 CC1=CC(N)=C(N)C=C1 AC-907/25014184 [2,0,0,0,0,0|1,0,0]=3 21 B9R1.69 CC1=CC=C(C)C(C)=N1 AO-801/41077394 [2,0,0,0,0,0|1,0,0]=3 22 B9R1.69 CC1=CC=C(O)C(N)=N1 AP-501/43408347 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.69 CC1=NC(C)=C(Br)C=C1 AC-907/34118035 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.69 CC1=NC(C)=C(N)C=C1 AJ-333/36120002 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.69 NC1=CC(Br)=CC=C1Br AE-641/00174041 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.69 NC1=CC(Br)=CC=C1Cl AN-584/42710811 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.69 NC1=CC=C(Br)C=C1N AQ-358/42003067 [2,0,0,0,0,0|2,0,0]=4 28 B11R1.17 CC1=C(OCCN)C=CC=C1 AE-641/00657056 [1,1,0,0,0,0|0,0,0]=2 29 B11R1.41 BrCCC1=C(CBr)C=CC=C1 AB-131/40897156 [1,1,0,0,0,0|1,0,0]=3 30 B11R1.41 COC1=C(CC#N)C=CC=C1 AK-087/40365554 [1,1,0,0,0,0|0,0,2]=4 31 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 AC-509/25002066 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.86 CC1=C(NC(N)=O)C=CC=C1 AR-360/41705362 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.157 NC(=O)CC1=CC=CC(F)=C1 AE-562/43460575 [1,1,0,0,0,0|1,0,1]=4 34 B11R1.189 COC1=CC(CCN)=CC=C1 AE-562/40171055 [1,1,0,0,0,0|0,0,0]=2 35 B11R1.37 COC1=C(OC)C=C(N)C=C1 AC-907/25014217 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.37 COC1=C(OC)C=C(O)C=C1 AE-508/42302277 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.72 CC1=CC=C(C)C(C=O)=C1O AJ-087/40189166 [1,1,0,0,0,0|1,0,1]=4 38 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 AE-562/43387288 [1,1,0,0,0,0|1,0,1]=4 39 B11R1.167 CC1=CC=[N+](C)C=C1C(N)=O AC-907/25004813 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.280 COC1=CC=C(N)C(CO)=C1 AN-584/43409805 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.893 CC1=CC(OCC(=O)O)=C(C)C=C1 AN-329/41081002 [0,2,0,0,0,0|1,0,1]=4 42 B11R2.106 NC1=C2CCCC2=CC=C1 AE-646/31213054 [1,0,0,1,0,0|2,0,0]=4 43 B13R2.369 OC1=C(O)C=C2CNCCC2=C1 AN-829/25059010 [0,1,0,1,0,0|1,0,0]=3