0 B10R1.1 CCCC1=CN=C(Cl)N=C1 RJC02409 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.1 CNCC1=CC=C(Cl)C=C1 MO00897 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.1 CNCC1=NC=C(Br)C=C1 MO07896 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.1 N#CCC1=CC=C(O)C=C1 SB00735 [0,0,0,0,0,0|1,0,1]=2 4 B10R1.1 OCCC1=CC=C(O)C=C1 SB01196 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.1 S=C=NC1=CC=C(I)C=C1 S00350 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.1 CC1=CC=C(CS)C=C1 TL00457 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.1 COC1=CC=C(I)C=N1 NP43893 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.1 NC1=CC=C(CO)C=N1 MO07396 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.1 NNC1=CC=C(I)C=C1 RF01374 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.1 O=CC1=CC=C(Br)C=C1 SB01132 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.1 OCC1=CC=C(Cl)C=C1 SB01197 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.1 OCC1=NC=C(Br)C=C1 MO07897 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.8 CNCC1=CC=CN=C1 TL00368 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.8 CNCC1=CC=NC=C1 MO00914 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.8 OCCC1=CC=CN=C1 KM09875 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 TL00596 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 KM10105 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.83 C#CC1=CC=C(CCC)C=C1 BTB09905 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.83 CCC1=CC=C(CNC)C=C1 MO00891 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.83 CNCC1=CC=C(OC)C=C1 MO00889 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.83 COC1=CC=C(N=C=S)C=C1 TL00326 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.83 N#CC1=CC=C(CCO)C=C1 TL00139 [0,1,0,0,0,0|2,0,0]=3 23 B11R2.36 BrC1=CC2=C(C=C1)OCC2 CC00810 [0,0,0,1,0,0|2,0,0]=3 24 B11R2.36 NC1=CC2=C(C=C1)OCC2 NP43803 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.7 CNCC1=CC(C)=CS1 CC30646 [0,0,0,0,1,0|3,0,0]=4 26 B9R1.7 CNCC1=CC=C(C)S1 CC65096 [0,0,0,0,1,0|3,0,0]=4 27 B8R1.3 CC1=CN=C(O)C=C1 AC35768 [2,0,0,0,0,0|1,0,0]=3 28 B10R1.3 C#CC1=CC=C(CC)C=C1 BTB09906 [1,1,0,0,0,0|1,0,0]=3 29 B10R1.3 O=CC1=CC=C(CBr)C=C1 MO07312 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.25 CSC1=C(N)C=C(Cl)C=C1 CD05201 [1,1,0,0,0,0|2,0,0]=4 31 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 KM10077 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.25 N#CC1=CC=C(O)C=C1F KM10855 [1,1,0,0,0,0|1,0,1]=4 33 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 TL00917 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.176 OCC1=CC(O)=C(I)C=C1 MO07809 [1,1,0,0,0,0|2,0,0]=4 35 B10R1.4 CNCC1=NC=CC=C1F CC30946 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.10 CNCC1=CC(Br)=CN=C1 CC67146 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.10 CNCC1=CC(Cl)=NC=C1 CC53646 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.17 NCCOC1=CC=CC=C1 RF03254 [1,1,0,0,0,0|1,0,0]=3 39 B12R1.1 CCCCOC1=CC=C(Br)C=C1 BTB09793 [0,2,0,0,0,0|1,0,0]=3 40 B12R1.1 ClC1=CC=C(OCCCI)C=C1 RH01447 [0,2,0,0,0,0|1,0,0]=3 41 B12R1.71 C#CC1=CC=C(CCCC)C=C1 BTB09904 [0,2,0,0,0,0|1,0,0]=3 42 B12R1.71 CCCCC1=CC=C(C#N)C=C1 TL00747 [0,2,0,0,0,0|1,0,0]=3 43 B12R1.71 CCCOC1=CC=C(C#N)C=C1 BTB09860 [0,2,0,0,0,0|1,0,0]=3 44 B12R1.71 COC1=CC=C(OCCN)C=C1 BTB10107 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.385 CCCCC1=CC=C(N)C(C)=C1 SB01607 [0,2,0,0,0,0|1,0,0]=3 46 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 CD00356 [0,2,0,0,0,0|1,0,1]=4 47 B12R1.113 CCNC1=CC=C(C(=O)O)C=C1 BTB10315 [0,2,0,0,0,0|1,0,0]=3 48 B12R1.113 CNCC1=CC=C([N+](=O)[O-])C=C1 MO00894 [0,2,0,0,0,0|1,0,1]=4 49 B12R1.116 CCOC1=CC=C(N=C=S)C=C1 SB01663 [0,2,0,0,0,0|1,1,0]=4 50 B10R2.7 C1=CC2=C(C=C1)OCO2 SB00944 [1,0,0,1,0,0|2,0,0]=4 51 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 CC32810 [0,1,0,1,0,0|1,0,0]=3 52 B12R2.24 NC1=CC=C2OCOCC2=C1 SEW03598 [0,1,0,1,0,0|2,0,0]=4 53 B12R2.612 CN1CCC2=C1C=CC(Br)=C2 CC58710 [0,1,0,1,0,0|2,0,0]=4 54 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 NRB01003 [0,1,0,1,0,0|1,0,1]=4 55 B12R2.612 O=C1COC2=C1C=CC(O)=C2 SEW02738 [0,1,0,1,0,0|1,0,1]=4 56 B12R2.44 NCC1=CC=C2OCCC2=C1 CC00813 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 CC00804 [0,1,0,1,0,0|1,0,1]=4