0 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 BB12-2577 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [0,0,0,0,0,0|1,0,2]=3 3 B11R1.22 CNC(C)C1=CC=C(F)C=C1 BB12-1331 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.22 [C-]#[N+]C(C)C1=CC=C(Cl)C=C1 BB56-1668 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.1 CNCC1=CC=C(O)C=C1 BB12-1375 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.1 N#CCC1=CC=C(N)C=C1 BB12-4851 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.1 [C-]#[N+]CC1=CC=C(Cl)C=C1 BB56-1770 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,0,0,0,0,0|1,0,1]=3 12 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,0,0,0,0,0|1,0,1]=3 13 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,0,0,0,0,0|0,0,0]=1 15 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [1,0,0,0,0,0|1,0,2]=4 17 B10R1.15 [C-]#[N+]C(C)C1=CC=NC=C1 BB56-1680 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.5 CCC(C)C1=CC=C(NN)C=C1 BB56-0337 [0,1,0,0,0,0|2,0,1]=4 19 B12R1.5 CSC1=CC=C(C(N)CO)C=C1 BB56-2165 [0,1,0,0,0,0|1,0,2]=4 20 B12R1.9 CC(N)(CO)C1=CC=C(F)C=C1 BB56-2780 [0,1,0,0,0,0|1,0,2]=4 21 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 BB12-4088 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 BB56-0268 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.20 NC(C(=O)O)C1=CC=C(I)C=C1 BB56-0239 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.367 CC1=CC=C(C(N)CO)C=C1C BB56-2162 [0,1,0,0,0,0|1,0,2]=4 25 B12R1.1703 CC1=CC=C(C(N)CO)C(C)=C1 BB56-2161 [0,1,0,0,0,0|1,0,2]=4 26 B10R1.14 [C-]#[N+]C(C)C1=CC=C(C)S1 BB56-1833 [0,0,0,0,1,0|3,0,0]=4 27 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [2,0,0,0,0,0|2,0,0]=4 30 B11R1.1 C(=O)NCC1=CC=C(C)C=C1 BB20-3386 [1,1,0,0,0,0|0,0,0]=2 31 B11R1.1 CC1=CC=C(CNC#N)C=C1 BB12-1087 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.1 CC1=CC=C(NCCO)C=C1 BB17-0653 [1,1,0,0,0,0|0,0,2]=4 33 B11R1.1 CC1=CC=C(SCCN)C=C1 BB53-1425 [1,1,0,0,0,0|1,0,1]=4 34 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 BB20-4553 [1,1,0,0,0,0|0,1,0]=3 37 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 BB56-2858 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.3 CC(C)C1=CC=C(NN)C=C1 BB56-1861 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 BB12-2672 [1,1,0,0,0,0|1,0,1]=4 42 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [1,1,0,0,0,0|1,0,1]=4 43 B11R1.21 CC(N)C1=CC(Cl)=C(Cl)C=C1 BB17-1112 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 BB53-1533 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 BB17-0720 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [1,1,0,0,0,0|1,0,1]=4 47 B11R1.16 CC(N=C=O)C1=CC=CC=C1 BB12-1551 [1,1,0,0,0,0|0,0,1]=3 48 B11R1.23 [C-]#[N+]C(C)C1=CC(Cl)=CC=C1 BB56-1669 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 BB20-4534 [1,1,0,0,0,0|1,0,0]=3 50 B13R1.133 CC(OC1=CC=C(O)C=C1)C(=O)O BB12-1748 [0,1,0,0,0,1|1,0,0]=3 51 B13R1.133 NC1=CC=C(CC(N)C(=O)O)C=C1 BB12-2267 [0,1,0,0,0,1|2,0,0]=4 52 B13R1.36 CCC1=CC=C(C(N)C(=O)O)C=C1 BB56-0235 [0,2,0,0,0,0|1,0,0]=3 53 B13R1.36 COC1=CC=C(C(N)C(=O)O)C=C1 BB56-0264 [0,2,0,0,0,0|1,0,0]=3 54 B13R1.36 CSC1=CC=C(C(N)C(=O)O)C=C1 BB56-0269 [0,2,0,0,0,0|1,0,0]=3 55 B13R1.3088 CNC(C)C1=CC(F)=C(OC)C=C1 BB53-1614 [0,2,0,0,0,0|2,0,0]=4 56 B13R1.522 CC(N)(C(=O)O)C1=CC=C(F)C=C1 BB56-0256 [0,2,0,0,0,0|1,0,0]=3 57 B13R1.522 CC1=CC=C(C(C)(N)C(=O)O)C=C1 BB56-2636 [0,2,0,0,0,0|0,0,0]=2 58 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 BB12-2877 [0,2,0,0,0,0|1,0,1]=4 59 B13R1.163 CC1=CC=C(C(N)C(=O)O)C(C)=C1 BB56-0186 [0,2,0,0,0,0|1,0,0]=3 60 B13R1.510 NC(C(=O)O)C1=CC=C(F)C(Br)=C1 BB56-0070 [0,2,0,0,0,0|2,0,0]=4 61 B11R2.36 CC1=CC=C2N=CNC2=C1 BB12-4747 [1,0,0,1,0,0|2,0,0]=4 62 B13R2.12 CC1=CC=C(C2CCCN2)C=C1 BB55-3979 [0,1,0,1,0,0|1,0,1]=4 63 B13R2.5190 CN1C(=O)CC2=CC(Br)=CC=C21 BB12-1851 [0,1,0,1,0,0|2,0,0]=4 64 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 BB17-2230 [1,0,0,0,0,1|1,0,1]=4