0 B11R2.1 NC1=NNC2=C1C=CC=C2 B047143 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.1 NC1=NNC2=NC=CC=C12 B040979 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.1 OC1=NNC2=C1C=CC=N2 B058963 [0,0,0,0,0,0|2,0,0]=2 3 B10R2.7 C1=CC2=C(N=C1)NN=C2 B039109 [1,0,0,0,0,0|2,0,0]=3 4 B12R2.132 CC1=NNC2=NC=C(N)C=C12 B051977 [0,1,0,0,0,0|3,0,0]=4 5 B12R2.196 CC1=NNC2=C1C=CC=C2N B049044 [0,1,0,0,0,0|2,0,0]=3 6 B12R2.196 CN1N=NC2=C1C=CC=C2N B047296 [0,1,0,0,0,0|3,0,0]=4 7 B12R2.203 CN1N=NC2=C1C(N)=CC=C2 B047297 [0,1,0,0,0,0|3,0,0]=4 8 B12R2.203 NC1=NNC2=C1C(F)=CC=C2 B047115 [0,1,0,0,0,0|2,0,0]=3 9 B12R2.612 CC1=CC=C2C(N)=NN=C2N1 B050605 [0,1,0,0,0,0|3,0,0]=4 10 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 B050678 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.15 C#CC(=O)C1=CC=CC=C1 B048976 [0,0,1,0,0,0|2,0,1]=4 12 B10R1.15 C\C(=N/O)C1=CC=NC=C1 B006530 [0,0,1,0,0,0|2,0,0]=3 13 B10R1.15 N\C(=N/O)C1=CC=CC=C1 B020566 [0,0,1,0,0,0|1,0,0]=2 14 B10R1.15 N\C(=N/O)C1=CC=NC=C1 B030084 [0,0,1,0,0,0|2,0,0]=3 15 B10R1.15 N\C(=N/O)C1=CN=CC=C1 B030080 [0,0,1,0,0,0|2,0,0]=3 16 B10R1.15 N\C(=N/O)C1=NC=CC=C1 B030083 [0,0,1,0,0,0|2,0,0]=3 17 B10R1.61 O=C(O)C1=CC=NC=C1Br B050303 [0,0,1,0,0,0|3,0,0]=4 18 B12R2.1081 ClC1=NC=NC2=CC=CC=C21 B039416 [0,0,0,0,0,1|2,0,0]=3 19 B12R2.1081 OC1=NC=NC2=C1C=CC=C2 B047245 [0,0,0,0,0,1|1,0,0]=2 20 B12R2.1081 SC1=NC=NC2=C1C=CC=C2 B016343 [0,0,0,0,0,1|1,1,0]=3 21 B9R1.15 COC1=CC=CN=C1O B039509 [1,0,1,0,0,0|2,0,0]=4 22 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 B022751 [0,1,1,0,0,0|1,0,0]=3 23 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 B022963 [0,1,1,0,0,0|1,0,0]=3 24 B11R1.22 N\C(=N\O)C1=CC=C(F)C=C1 B030589 [0,1,1,0,0,0|1,0,0]=3 25 B11R1.222 N\C(=N/O)C1=CC=CC=C1F B034860 [0,1,1,0,0,0|1,0,0]=3 26 B11R1.222 N\C(=N/O)C1=CC=CN=C1Cl B050332 [0,1,1,0,0,0|2,0,0]=4 27 B11R1.1 NC1=CC=C(OCCO)C=C1 B030702 [0,1,1,0,0,0|1,0,1]=4 28 B11R1.1 NC1=CC=C(OCCO)C=C1 B038630 [0,1,1,0,0,0|1,0,1]=4 29 B11R1.17 NC1=CC=CC=C1OCCO B030703 [0,1,1,0,0,0|1,0,1]=4 30 B11R1.91 O=C(O)CNC1=CC=CC=C1 B003332 [0,1,1,0,0,0|2,0,0]=4 31 B11R1.37 COC1=CC=C(Br)C=C1C=O B005855 [0,1,1,0,0,0|1,0,1]=4 32 B11R1.53 NCC1=CC=CC=C1C(=O)O B049870 [0,1,1,0,0,0|1,0,1]=4 33 B11R1.53 O=C(O)C1=C(CBr)C=CC=C1 B019566 [0,1,1,0,0,0|2,0,0]=4 34 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=C1 B048630 [0,1,1,0,0,0|2,0,0]=4 35 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 B048728 [0,1,1,0,0,0|1,0,0]=3 36 B11R1.159 NC1=CC=CC(C(=O)O)=C1N B050432 [0,1,1,0,0,0|2,0,0]=4 37 B11R2.10 NC1=NC2=CC=CC=C2O1 B039652 [1,1,0,0,0,0|2,0,0]=4 38 B11R2.36 NC1=CC2=C(C=C1)C=NN2 B019849 [1,1,0,0,0,0|1,0,0]=3 39 B11R2.36 NC1=CC2=C(C=CN2)C=C1 B050532 [1,1,0,0,0,0|2,0,0]=4 40 B11R2.36 NC1=CC2=C(N=C1)NN=C2 B047095 [1,1,0,0,0,0|2,0,0]=4 41 B11R2.106 NC1=C2NN=CC2=CC=C1 B049588 [1,1,0,0,0,0|1,0,0]=3 42 B13R2.57 OCC1=CC2=C(C=CC=C2)N=C1 B037016 [0,1,0,0,0,1|2,0,0]=4 43 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 B041296 [0,1,0,0,0,1|2,0,0]=4 44 B13R2.5179 O=C1COC2=C(Cl)C=CC=C2N1 B050324 [0,1,0,0,0,1|1,0,1]=4 45 B13R2.1613 N#CC1=C2C=CC=CC2=CC=N1 B049269 [0,1,0,0,0,1|2,0,0]=4 46 B13R2.1613 NCC1=NC=CC2=CC=CC=C21 B049485 [0,1,0,0,0,1|2,0,0]=4 47 B13R2.45 N#CC1=C(N)C2=C(C=CC=C2)O1 B050460 [0,2,0,0,0,0|2,0,0]=4 48 B13R2.11642 CC1=CC(=O)NC2=C1C(C)=NO2 B039032 [0,2,0,0,0,0|2,0,0]=4 49 B9R1.11 C\C(=N/O)C1=CC=CO1 B006531 [0,0,1,0,1,0|2,0,0]=4