0 B10R1.3 C#CC1=CN=C(OC)C=C1 SPC-k103 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.3 COC1=CN=C(C#N)C=C1 SPC-k938 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.3 COC1=CN=C(C#N)N=C1 SPC-p716 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.3 COC1=CN=C(C=O)N=C1 SPC-u633 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.3 COC1=CN=C(CCl)C=C1 SPC-m285 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.3 COC1=CN=C(CCl)N=C1 SPC-r241 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.3 COC1=CN=C(CO)C=C1 SPC-n798 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.3 COC1=NC=C(C#N)C=N1 SPC-v219 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.3 COC1=NC=C(C=O)C=C1 SPC-n262 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.3 COC1=NC=C(CN)C=C1 SPC-j639 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.3 COC1=NC=C(CN)C=N1 SPC-u784 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.3 COC1=NC=C(CO)C=C1 SPC-j652 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.3 COC1=NC=C(CO)C=N1 SPC-m769 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.3 O=CC1=CC=C(CCl)C=C1 SPC-u418 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.1 C#CC1=CC=C(Cl)C=C1 SPC-j149 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.1 C#CC1=CC=C(N)C=C1 SPC-t770 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.1 CC1=NC=C(C#N)C=C1 SPC-t730 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.1 CC1=NC=C(C=O)C=C1 SPC-g684 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 CC1=NC=C(CN)C=C1 SPC-j627 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.1 CCC1=NC=C(Br)C=C1 SPC-n190 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 COC1=CN=C(Br)N=C1 SPC-h175 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.1 COC1=CN=C(Cl)N=C1 SPC-g227 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.1 COC1=CN=C(F)C=C1 SPC-v061 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.1 COC1=CN=C(N)C=C1 SPC-g838 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.1 COC1=CN=C(N)N=C1 SPC-p715 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 COC1=NC=C(Br)C=C1 SPC-j898 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.1 COC1=NC=C(N)C=C1 SPC-g246 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.1 NNC1=CC=C(F)C=C1 SPC-k289 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.1 O=CC1=NC=C(O)C=C1 SPC-u413 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.3 COC1=CN=C(C(=O)O)C=C1 SPC-k940 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.3 COC1=NC=C(B(O)O)C=C1 SPC-j894 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SPC-t080 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.83 COC1=CC=C(CNN)C=C1 SPC-j055 [0,1,0,0,0,0|2,0,0]=3 33 B8R1.3 CC1=CN=C(Br)C=C1 SPC-g114 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.3 CC1=CN=C(F)C=C1 SPC-s869 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.3 CC1=NC=C(Br)C=C1 SPC-p658 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.3 CC1=NC=C(N)C=C1 SPC-n264 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.3 CC1=NC=C(O)C=N1 SPC-r244 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.3 CC1=NN=C(O)C=C1 SPC-g136 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.3 CC1=NN=C(O)C=C1 SPC-t081 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.3 OC1=CN=C(Br)C=C1 SPC-g192 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.3 OC1=CN=C(Cl)C=C1 SPC-g273 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.1 FC1=CC=C(CCBr)C=C1 SPC-g391 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.1 NCCC1=CC=C(N)C=C1 SPC-r402 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.13 OB(O)C1=CC=C(O)C=C1 SPC-s693 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.25 COC1=C(Cl)C=C(N)N=C1 SPC-t002 [1,1,0,0,0,0|2,0,0]=4 46 B10R1.25 COC1=C(F)C=C(Br)C=C1 SPC-g047 [1,1,0,0,0,0|1,0,0]=3 47 B10R1.25 COC1=NC=C(Br)C=C1N SPC-g377 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.25 COC1=NC=C(Br)C=C1O SPC-r179 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.176 COC1=CC(Br)=C(C)N=C1 SPC-j935 [1,1,0,0,0,0|1,0,0]=3 50 B10R1.176 COC1=CC(F)=C(Br)C=N1 SPC-t441 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.176 COC1=CC(I)=C(N)C=C1 SPC-r017 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.176 COC1=CC(N)=C(Br)C=N1 SPC-n191 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 SPC-j651 [0,2,0,0,0,0|1,0,0]=3 54 B12R1.5 COC(=O)C1=NC=C(OC)C=C1 SPC-k939 [0,2,0,0,0,0|1,0,0]=3 55 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 SPC-v364 [0,2,0,0,0,0|2,0,0]=4 56 B12R2.44 COC1=CC2=C(C=C1)NN=C2 SPC-j448 [0,1,0,1,0,0|1,0,1]=4 57 B12R2.44 COC1=CC2=C(C=CN2)C=C1 SPC-p812 [0,1,0,1,0,0|1,0,1]=4 58 B12R2.44 COC1=NC=C2NCCC2=C1 SPC-u822 [0,1,0,1,0,0|2,0,0]=4 59 B10R1.172 COC1=CC(C=O)=CN=C1 SPC-g844 [0,0,0,0,1,1|2,0,0]=4 60 B10R1.172 COC1=CN=CC(CN)=C1 SPC-n799 [0,0,0,0,1,1|2,0,0]=4 61 B10R1.172 COC1=NC=CC(C=O)=C1 SPC-h062 [0,0,0,0,1,1|2,0,0]=4 62 B10R1.172 COC1=NC=CC(CCl)=C1 SPC-s960 [0,0,0,0,1,1|2,0,0]=4 63 B10R1.172 COC1=NC=CC(CN)=C1 SPC-j640 [0,0,0,0,1,1|2,0,0]=4