0 B9R1.1 CC1=CC=C(CS)C=C1 105406 [1,0,0,0,0,0|0,1,1]=3 1 B9R1.1 CC1=CN=C(CN)C=C1 065464 [1,0,0,0,0,0|2,0,1]=4 2 B9R1.1 CNC1=CC=C(I)C=C1 045902 [1,0,0,0,0,0|2,0,0]=3 3 B9R1.1 COC1=NC=C(I)C=C1 033478 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.3 COC1=CC=C(S(=O)[O-])C=C1 097673 [0,1,0,0,0,0|1,0,0]=2 5 B11R1.3 COC1=CC=C(S(C)=O)C=C1 094784 [0,1,0,0,0,0|1,0,0]=2 6 B11R1.83 C=CCC1=CC=C(SC)C=C1 022328 [0,1,0,0,0,0|1,1,0]=3 7 B11R1.83 C\C=C\c1ccc(OC)cc1 195015 [0,1,0,0,0,0|1,0,0]=2 8 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 021037 [0,1,0,0,0,0|1,0,1]=3 9 B11R1.279 COC1=CC=C(SC)C=C1S 070484 [0,1,0,0,0,0|2,0,0]=3 10 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|0,0,0]=2 11 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,1]=4 12 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [2,0,0,0,0,0|1,0,1]=4 13 B8R1.3 CC1=NC=C(I)C=C1 080146 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.1 CC1=CC=C(CON)C=C1 025883 [1,1,0,0,0,0|0,0,2]=4 15 B10R1.1 CCOC1=CC=C(S)C=C1 038427 [1,1,0,0,0,0|0,1,0]=3 16 B10R1.1 CCSC1=CC=C(S)C=C1 023079 [1,1,0,0,0,0|0,2,0]=4 17 B10R1.1 COCC1=CC=C(N)C=C1 098494 [1,1,0,0,0,0|1,0,0]=3 18 B10R1.13 CN(C)C1=CC=C(N)C=C1 106160 [1,1,0,0,0,0|2,0,0]=4 19 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 064474 [1,1,0,0,0,0|1,1,0]=4 20 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 064485 [1,1,0,0,0,0|1,1,0]=4 21 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 097856 [1,1,0,0,0,0|2,0,0]=4 22 B10R1.25 CC1=CC(C)=C(CO)C=C1 049893 [1,1,0,0,0,0|0,0,2]=4 23 B10R1.25 CC1=CC=C(CBr)C(C)=C1 221500 [1,1,0,0,0,0|1,0,1]=4 24 B10R1.25 COC1=C(F)C=C(C)C=C1 009215 [1,1,0,0,0,0|0,0,1]=3 25 B10R1.25 COC1=C(F)C=C(I)C=C1 038782 [1,1,0,0,0,0|1,0,0]=3 26 B10R1.25 COC1=C(O)C=C(C)C=C1 009947 [1,1,0,0,0,0|0,0,1]=3 27 B10R1.25 O=CC1=CC=C(Cl)N=C1F 075267 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.176 CC1=C(N)C=C(CN)C=C1 075753 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.176 CCC1=CC=C(S)C(Br)=C1 061618 [1,1,0,0,0,0|1,1,0]=4 30 B10R1.176 COC1=CC=C(Br)C(S)=C1 062585 [1,1,0,0,0,0|1,0,0]=3 31 B10R1.176 COC1=CC=C(I)C(N)=C1 062579 [1,1,0,0,0,0|1,0,0]=3 32 B10R1.176 COC1=CC=C(S)C(C)=C1 023081 [1,1,0,0,0,0|0,1,0]=3 33 B10R1.176 CSC1=CC=C(Br)C(S)=C1 070273 [1,1,0,0,0,0|1,1,0]=4 34 B10R1.176 CSC1=CC=C(C)C(S)=C1 070026 [1,1,0,0,0,0|0,1,1]=4 35 B10R1.176 CSC1=CC=C(Cl)C(S)=C1 070092 [1,1,0,0,0,0|1,1,0]=4 36 B10R1.31 CCC1=CC=C(C(=O)O)S1 014517 [0,1,0,0,1,0|2,0,0]=4 37 B12R1.48 CNC1=CC=C([N+](=O)[O-])C=C1C 330119 [0,2,0,0,0,0|2,0,0]=4 38 B12R1.48 COC1=C(I)C=C(C(=O)Cl)C=C1 038117 [0,2,0,0,0,0|0,0,0]=2 39 B12R1.48 COC1=CC=C(C(C)C)C=C1N 491146 [0,2,0,0,0,0|1,0,1]=4 40 B12R1.113 COCC1=CC=C([N+](=O)[O-])C=C1 342281 [0,2,0,0,0,0|1,0,0]=3 41 B12R1.452 COC1=CC(C)=C(C(C)=O)C=C1 396494 [0,2,0,0,0,0|0,0,0]=2 42 B12R1.452 COC1=CC=C(C(C)=O)C(Br)=C1 335944 [0,2,0,0,0,0|0,0,0]=2 43 B12R1.4 COC1=CC=C(NC(C)=S)C=C1 331458 [0,2,0,0,0,0|0,1,0]=3 44 B12R1.4 FC(F)OC1=CC=C(CS)C=C1 038303 [0,2,0,0,0,0|0,1,1]=4 45 B12R1.71 N#CC1=CC=C(OCCBr)C=C1 095958 [0,2,0,0,0,0|1,0,1]=4 46 B12R1.114 CCOC1=C(F)C=C(C#N)C=C1 070636 [0,2,0,0,0,0|1,0,1]=4 47 B12R1.114 CCOC1=C(F)C=C(C=O)C=C1 214362 [0,2,0,0,0,0|0,0,0]=2 48 B12R1.114 CCOC1=C(F)C=C(CN)C=C1 070641 [0,2,0,0,0,0|1,0,1]=4 49 B12R1.114 CCOC1=CC=C(C=O)C=C1C 038829 [0,2,0,0,0,0|0,0,0]=2 50 B12R1.116 C=CCC1=CC=C(SCC)C=C1 022321 [0,2,0,0,0,0|1,1,0]=4 51 B12R1.288 C=CCC1=CC=C(OC)C(F)=C1 022322 [0,2,0,0,0,0|1,0,0]=3 52 B12R1.288 COC1=C(Br)C=C(N=C=O)C=C1 105480 [0,2,0,0,0,0|0,0,1]=3 53 B12R1.78 CNC1=CC(OC)=C(OC)C=C1 045889 [0,2,0,0,0,0|2,0,0]=4 54 B12R1.301 COC1=CC(F)=C(C#N)C(F)=C1 033423 [0,2,0,0,0,0|1,0,1]=4 55 B12R2.44 COC1=CC2=C(C=C1)NN=C2 092863 [0,1,0,1,0,0|2,0,0]=4 56 B10R1.172 CCC1=CC(C=O)=CC=C1 216622 [0,0,0,0,1,1|1,0,0]=3