0 B11R1.279 COC1=CC=C(SC)C=C1S 070484 [0,0,0,0,0,0|2,2,0]=4 1 B10R1.25 CC1=CC(C)=C(CO)C=C1 049893 [1,0,0,0,0,0|1,0,2]=4 2 B10R1.25 CC1=CC=C(CBr)C(C)=C1 221500 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.25 COC1=C(F)C=C(C)C=C1 009215 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.25 COC1=C(O)C=C(C)C=C1 009947 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.25 O=CC1=CC=C(Cl)N=C1F 075267 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.25 OCC1=CC=C(Br)C=C1O 217533 [1,0,0,0,0,0|1,0,2]=4 7 B10R1.176 CCC1=CC=C(S)C(Br)=C1 061618 [1,0,0,0,0,0|2,1,0]=4 8 B10R1.176 COC1=CC=C(Br)C(S)=C1 062585 [1,0,0,0,0,0|1,1,0]=3 9 B10R1.176 COC1=CC=C(I)C(N)=C1 062579 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.176 COC1=CC=C(S)C(C)=C1 023081 [1,0,0,0,0,0|1,1,0]=3 11 B10R1.176 CSC1=CC=C(Br)C(S)=C1 070273 [1,0,0,0,0,0|1,2,0]=4 12 B10R1.176 CSC1=CC=C(C)C(S)=C1 070026 [1,0,0,0,0,0|0,2,1]=4 13 B10R1.176 CSC1=CC=C(Cl)C(S)=C1 070092 [1,0,0,0,0,0|1,2,0]=4 14 B12R1.78 CNC1=CC(OC)=C(OC)C=C1 045889 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.301 COC1=CC(F)=C(C#N)C(F)=C1 033423 [0,1,0,0,0,0|2,0,1]=4 16 B12R1.452 COC1=CC(C)=C(C(C)=O)C=C1 396494 [0,1,0,0,0,0|1,0,0]=2 17 B12R1.452 COC1=CC=C(C(C)=O)C(Br)=C1 335944 [0,1,0,0,0,0|1,0,0]=2 18 B12R2.44 COC1=CC2=C(C=C1)NN=C2 092863 [0,0,0,1,0,0|3,0,0]=4 19 B9R1.1 CC1=CC=C(CS)C=C1 105406 [2,0,0,0,0,0|0,1,1]=4 20 B9R1.1 CNC1=CC=C(I)C=C1 045902 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.1 COC1=NC=C(I)C=C1 033478 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.15 CC1=CC=NC=C1C=O 065210 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.69 CC1=CC(F)=C(S)C=C1 037941 [2,0,0,0,0,0|1,1,0]=4 24 B9R1.69 CC1=CC(I)=C(Cl)C=C1 070844 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.69 CC1=CC(S)=C(Cl)C=C1 070848 [2,0,0,0,0,0|1,1,0]=4 26 B9R1.69 CC1=CC=C(S)C(Br)=C1 037914 [2,0,0,0,0,0|1,1,0]=4 27 B9R1.2 CSC1=CC=CC(S)=C1 037948 [2,0,0,0,0,0|0,2,0]=4 28 B11R1.3 COC1=CC=C(S(=O)[O-])C=C1 097673 [1,1,0,0,0,0|1,0,0]=3 29 B11R1.3 COC1=CC=C(S(C)=O)C=C1 094784 [1,1,0,0,0,0|1,0,0]=3 30 B11R1.83 C=CCC1=CC=C(SC)C=C1 022328 [1,1,0,0,0,0|1,1,0]=4 31 B11R1.83 C\C=C\c1ccc(OC)cc1 195015 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 021037 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 075241 [1,1,0,0,0,0|1,0,0]=3 34 B11R1.37 COC1=CC(C)=CC=C1C=O 038667 [1,1,0,0,0,0|0,0,0]=2 35 B11R1.166 NC(=O)C1=C(F)C=C(N)C=C1 432306 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.277 CC1=CC(Cl)=C(Cl)C=C1C=O 214355 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.277 O=CC1=C(F)C=C(Cl)C(Cl)=C1 463973 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.278 CC1=C(Br)C=CC(C=O)=C1C 069410 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.278 CC1=C(Br)C=CC(C=O)=C1Cl 099911 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.278 CC1=C(C=O)C=CC(Br)=C1Cl 069690 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.278 CC1=C(Cl)C=CC(C=O)=C1C 069413 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.278 O=CC1=C(Cl)C(Cl)=C(Cl)C=C1 097792 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.278 O=CC1=C(Cl)C(F)=C(F)C=C1 093797 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.278 O=CC1=C(F)C(Cl)=C(Cl)C=C1 069712 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.278 O=CC1=CC=C(I)C(F)=C1F 037602 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.464 CC1=C(C=O)C(Cl)=CC(Cl)=C1 214348 [1,1,0,0,0,0|2,0,0]=4 47 B11R1.464 CC1=CC(Br)=CC(C)=C1C=O 231102 [1,1,0,0,0,0|2,0,0]=4 48 B11R1.464 CC1=CC(Cl)=C(C=O)C(Cl)=C1 097674 [1,1,0,0,0,0|1,0,0]=3 49 B11R1.14 COC1=CC(Br)=C(Cl)C(N)=C1 062584 [1,1,0,0,0,0|2,0,0]=4 50 B11R1.21 CC(=O)C1=CC(O)=C(I)C=C1 105437 [1,1,0,0,0,0|2,0,0]=4 51 B11R1.192 CCOC1=CC(Cl)=C(F)C=C1 013278 [1,1,0,0,0,0|2,0,0]=4 52 B11R1.280 COC1=CC(OC)=C(C)C=C1 045100 [1,1,0,0,0,0|0,0,1]=3 53 B13R1.38 CC(C)(C)C1=CC(Br)=C(C=O)C=C1 043384 [0,2,0,0,0,0|2,0,0]=4 54 B13R1.3096 COC1=CC=C(C(=O)O)C(F)=C1F 013818 [0,2,0,0,0,0|1,0,0]=3 55 B13R1.434 COC1=CC(C)=C(C#N)C(OC)=C1 104891 [0,2,0,0,0,0|1,0,1]=4 56 B13R1.1249 [C-]#[N+]CC1=C(OC)C=C(OC)C=C1 105477 [0,2,0,0,0,0|1,0,1]=4 57 B13R1.428 COC1=CC(F)=C(C(C)=O)C(F)=C1 241885 [0,2,0,0,0,0|1,0,0]=3 58 B13R2.2121 COC1=CC=C2NC(N)=NC2=C1 064967 [0,1,0,1,0,0|2,0,0]=4 59 B11R1.9 CCC1=CC(C=O)=CC(C)=C1 038648 [0,0,0,0,1,1|2,0,0]=4 60 B11R1.9 COC1=CC(Br)=CC(C=O)=C1 225755 [0,0,0,0,1,1|1,0,0]=3