0 B9R1.1 NCC1=CC=C(N)C=C1 B049905 [1,0,0,0,0,0|2,0,1]=4 1 B9R1.1 NCC1=CC=C(O)C=C1 B039583 [1,0,0,0,0,0|2,0,1]=4 2 B9R1.15 COC1=CC=CN=C1O B039509 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.15 NC1=C(C=O)C=NC=C1 B050347 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.15 NC1=NC=CC=C1C=O B049085 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.69 CC1=NC(C)=C(N)C=C1 B049993 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.69 CC1=NC(C)=C(O)C=C1 B049973 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.69 NC1=CC(Br)=C(F)C=C1 B049228 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.69 NC1=CC(N)=C(N)C=C1 B050159 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 B006832 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.279 COC1=C(O)C=C(CN)C=C1 B048498 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.279 COC1=CC=C(C#N)C=C1O B049493 [0,1,0,0,0,0|2,0,1]=4 12 B11R2.36 NC1=CC2=C(C=C1)C=NN2 B019849 [0,0,0,1,0,0|3,0,0]=4 13 B11R2.36 NC1=CC2=C(C=CN2)C=C1 B050532 [0,0,0,1,0,0|3,0,0]=4 14 B9R1.22 CC1=CC(C=O)=C(C)S1 B018517 [0,0,0,0,1,0|2,0,0]=3 15 B9R1.22 CC1=CN(C)C(C=O)=N1 B047108 [0,0,0,0,1,0|3,0,0]=4 16 B9R1.22 CC1=CN(C)N=C1C=O B047533 [0,0,0,0,1,0|3,0,0]=4 17 B9R1.22 CC1=NN(C)C(C=O)=C1 B015985 [0,0,0,0,1,0|3,0,0]=4 18 B9R1.22 CC1=NN(C)C=C1C=O B000370 [0,0,0,0,1,0|3,0,0]=4 19 B9R1.22 CN1C=C(Br)C(C=O)=N1 B007392 [0,0,0,0,1,0|3,0,0]=4 20 B9R1.22 CN1C=C(C=O)C(Br)=N1 B059872 [0,0,0,0,1,0|3,0,0]=4 21 B9R1.22 CN1C=C(C=O)C(I)=N1 B059893 [0,0,0,0,1,0|3,0,0]=4 22 B9R1.22 CN1C=C(Cl)C(C=O)=N1 B007391 [0,0,0,0,1,0|3,0,0]=4 23 B9R1.22 CN1C=C(I)C(C=O)=N1 B060739 [0,0,0,0,1,0|3,0,0]=4 24 B9R1.132 C(=O)C1=C(F)N(C)N=C1 B052499 [0,0,0,0,1,0|3,0,0]=4 25 B9R1.132 CC1=C(C=O)C=NN1C B000392 [0,0,0,0,1,0|3,0,0]=4 26 B9R1.132 CC1=CN=C(C=O)N1C B047107 [0,0,0,0,1,0|3,0,0]=4 27 B9R1.132 CN1N=CC(C=O)=C1Br B059882 [0,0,0,0,1,0|3,0,0]=4 28 B10R1.1 CC1=CC=C(CON)C=C1 B018552 [1,1,0,0,0,0|0,0,2]=4 29 B10R1.3 COC1=CC=C(NN)C=C1 B048983 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.3 N#CC1=CC=C(CCl)C=C1 B030136 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.13 O=C(O)C1=CC=C(O)N=C1 B049653 [1,1,0,0,0,0|2,0,0]=4 32 B10R1.61 O=C(O)C1=CC=NC=C1Br B050303 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O B050312 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.22 CC1=C(O)C=C(O)C=C1O B049970 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 B007490 [0,1,0,0,1,0|2,0,0]=4 36 B12R1.1703 NNC(=O)C1=C(Cl)C=C(Cl)C=C1 B051575 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.126 CC1=CC(C)=C(S(=O)(=O)Cl)C=C1 B019390 [0,2,0,0,0,0|2,0,0]=4 38 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N B020019 [0,2,0,0,0,0|1,0,1]=4 39 B12R1.1000 NC1=CC(Cl)=CC(Cl)=C1C(=O)O B049671 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.449 COC1=C(O)C=C(Br)C(C=O)=C1 B004167 [0,2,0,0,0,0|2,0,0]=4 41 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 B050678 [0,1,0,1,0,0|1,0,0]=3 42 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 B049148 [0,1,0,1,0,0|2,0,0]=4 43 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 B048996 [0,1,0,1,0,0|2,0,0]=4 44 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 B049000 [0,1,0,1,0,0|1,1,0]=4 45 B12R2.606 SC1=NC2=CC=C(Cl)C=C2O1 B039594 [0,1,0,1,0,0|1,1,0]=4 46 B12R2.44 NCC1=CC2=C(C=C1)OCO2 B019914 [0,1,0,1,0,0|2,0,0]=4 47 B8R1.1 C(=O)C1=CC=C(F)S1 B039130 [1,0,0,0,1,0|2,0,0]=4 48 B8R1.1 CC1=CC=C(C=O)S1 B015983 [1,0,0,0,1,0|1,0,0]=3 49 B8R1.1 CC1=NNC(C=O)=C1 B014001 [1,0,0,0,1,0|2,0,0]=4 50 B8R1.1 CN1C=C(C=O)C=N1 B000400 [1,0,0,0,1,0|2,0,0]=4 51 B8R1.1 CN1C=CC(C=O)=N1 B007390 [1,0,0,0,1,0|2,0,0]=4 52 B8R1.1 O=CC1=CC=C(Cl)S1 B022480 [1,0,0,0,1,0|2,0,0]=4 53 B8R1.1 O=CC1=CSC(Br)=C1 B059806 [1,0,0,0,1,0|2,0,0]=4