0 B12R2.612 CC1=NC2=C(C=C1)C(N)=NN2 BB0219104 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 BB0217042 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 BB0267948 [0,0,0,0,0,0|2,1,1]=4 3 B11R2.1 NC1=NOC2=C1C=CC=C2 BB0218926 [1,0,0,0,0,0|2,0,0]=3 4 B11R2.1 SC1=NN=C2C=CC=CN12 BB0270222 [1,0,0,0,0,0|1,1,1]=4 5 B11R2.36 BrC1=NC2=C(C=CN2)C=C1 BB0268359 [1,0,0,0,0,0|2,1,0]=4 6 B11R2.36 CC1=CC2=C(C=C1)N=CN2 BB0266899 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.662 NCC1=NNC2=C1C=CC(F)=C2 BB0270495 [0,1,0,0,0,0|1,1,0]=3 8 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O BB0268090 [0,1,0,0,0,0|1,0,1]=3 9 B13R2.11642 CC1=CC(C)=NC2=C1C(N)=NN2 BB0219105 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 BB0258400 [0,0,1,0,0,0|2,0,1]=4 11 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 BB0267982 [0,0,1,0,0,0|2,0,1]=4 12 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 BB0269544 [0,0,1,0,0,0|1,1,1]=4 13 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB0240957 [0,0,1,0,0,0|0,1,2]=4 14 B11R1.24 CC1=CC=CC(NCCO)=C1 BB0266927 [0,0,1,0,0,0|2,0,1]=4 15 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 BB0267268 [0,0,1,0,0,0|1,0,2]=4 16 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 BB0217598 [0,0,1,0,0,0|0,0,2]=3 17 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB0267060 [0,0,1,0,0,0|3,0,0]=4 18 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O BB0261924 [0,0,1,0,0,0|2,0,0]=3 19 B13R2.3683 ClC1=NC=C2C=C(Br)C=CC2=N1 BB0268354 [0,0,0,0,0,1|2,1,0]=4 20 B13R2.3683 OC1=CC=C2C=C(Br)C=CC2=C1 BB0220620 [0,0,0,0,0,1|2,1,0]=4 21 B13R2.5179 ClC1=C2C=CC(Br)=CC2=NC=N1 BB0294494 [0,0,0,0,0,1|1,1,1]=4 22 B10R1.1 NNCC1=CC=C(Cl)C=C1 BB0219968 [1,0,1,0,0,0|0,0,2]=4 23 B10R1.1 O\N=C\C1=CC=C(O)C=C1 BB0256552 [1,0,1,0,0,0|2,0,0]=4 24 B10R1.13 O=C(O)C1=CC=C(I)C=C1 BB0268012 [1,0,1,0,0,0|1,1,0]=4 25 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 BB0263306 [1,0,1,0,0,0|2,0,0]=4 26 B10R1.15 C\C(=N/O)C1=CC=CC=C1 BB0268020 [1,0,1,0,0,0|2,0,0]=4 27 B10R1.10 O\N=C\C1=CC(O)=CC=C1 BB0291837 [1,0,1,0,0,0|2,0,0]=4 28 B10R1.61 CC1=C(C(=O)O)C=CC=C1 BB0269526 [1,0,1,0,0,0|2,0,0]=4 29 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 BB0285709 [1,0,1,0,0,0|2,0,0]=4 30 B10R2.7 C1=CC2=C(C=C1)NN=C2 BB0219702 [2,0,0,0,0,0|0,0,0]=2 31 B10R2.7 C1=CC2=C(C=N1)NN=C2 BB0272399 [2,0,0,0,0,0|1,0,0]=3 32 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 BB0254086 [0,1,1,0,0,0|2,0,0]=4 33 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 BB0245370 [0,1,1,0,0,0|2,0,0]=4 34 B12R2.1 N#CC1=CNC2=C1C=CC=C2 BB0242412 [1,1,0,0,0,0|2,0,0]=4 35 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 BB0268501 [1,1,0,0,0,0|2,0,0]=4 36 B12R2.132 OC1=NNC2=C1C=C(I)C=C2 BB0268362 [1,1,0,0,0,0|0,0,0]=2 37 B12R2.203 NC1=NOC2=CC=CC(F)=C21 BB0259633 [1,1,0,0,0,0|2,0,0]=4 38 B12R2.44 N#CC1=CC2=C(C=CN2)C=C1 BB0266819 [1,1,0,0,0,0|2,0,0]=4 39 B12R2.44 NCC1=CC2=C(C=CN2)C=C1 BB0253243 [1,1,0,0,0,0|2,0,0]=4 40 B12R2.100 CC1=C(Cl)C=C2NC=NC2=C1 BB0267116 [1,1,0,0,0,0|2,0,0]=4 41 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 BB0265944 [1,1,0,0,0,0|1,0,1]=4 42 B14R2.8038 CC1=C(Cl)C=CC2=C(O)C=CN=C12 BB0263743 [0,1,0,0,0,1|1,0,1]=4 43 B14R2.28472 OC1=C2C=C(Br)C(Cl)=CC2=NC=C1 BB0263774 [0,1,0,0,0,1|1,0,1]=4 44 B14R2.300 O=C(O)C1=NNC2=C1C=CC(F)=C2 BB0261012 [0,2,0,0,0,0|0,1,0]=3 45 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 BB0284990 [0,0,1,0,0,1|0,0,2]=4