0 B10R1.15 NNC(=S)C1=CC=CC=C1 BB17-0201 [0,0,1,0,0,0|2,1,0]=4 1 B10R1.61 NC1=CC=CN=C1C(=O)O BB01-8355 [0,0,1,0,0,0|2,0,0]=3 2 B10R1.61 NC1=NC=CC=C1C(=O)O BB17-0064 [0,0,1,0,0,0|2,0,0]=3 3 B12R2.24 OC1=CC=C2C=CC=CC2=N1 BB17-2144 [0,0,0,0,0,1|1,0,2]=4 4 B12R2.1081 O=C1CCSC2=C1C=CC=C2 BB01-5930 [0,0,0,0,0,1|1,0,0]=2 5 B9R1.6 N=C(N)C1=CC=CC=C1 BB01-6195 [1,0,1,0,0,0|2,0,0]=4 6 B9R1.8 O=CCC1=CC=CC=C1 BB01-5910 [1,0,1,0,0,0|0,0,0]=2 7 B9R1.15 O=CC1=C(F)C=NC=C1 BB01-8337 [1,0,1,0,0,0|2,0,0]=4 8 B11R1.23 COC(=O)C1=CC=CC(N)=C1 BB17-0320 [0,1,1,0,0,0|0,0,0]=2 9 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 BB01-4965 [0,1,1,0,0,0|2,0,0]=4 10 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 BB17-1115 [0,1,1,0,0,0|2,0,0]=4 11 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 BB17-2141 [0,1,1,0,0,0|0,0,0]=2 12 B11R1.222 COC(=O)C1=NC=CN=C1N BB01-8312 [0,1,1,0,0,0|2,0,0]=4 13 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 BB01-5022 [0,1,1,0,0,0|2,0,0]=4 14 B11R1.1 O=C\C=C\C1=CC=C(Br)C=C1 BB17-2312 [0,1,1,0,0,0|1,0,1]=4 15 B11R1.91 N=C(N)NCC1=CC=CC=C1 BB53-1255 [0,1,1,0,0,0|2,0,0]=4 16 B11R1.37 COC1=C(C=O)C=C(Br)C=C1 BB17-1168 [0,1,1,0,0,0|2,0,0]=4 17 B11R1.37 COC1=CC=C(I)C=C1C=O BB17-2247 [0,1,1,0,0,0|2,0,0]=4 18 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 BB17-0631 [0,1,1,0,0,0|2,0,0]=4 19 B11R1.265 COC1=C(C=O)C=CC=C1C BB17-1110 [0,1,1,0,0,0|2,0,0]=4 20 B11R1.156 O=C(O)C1=C(F)C=CC=C1Cl BB17-1899 [0,1,1,0,0,0|1,0,0]=3 21 B11R1.156 O=C(O)C1=C(F)C=CC=C1F BB01-8298 [0,1,1,0,0,0|1,0,0]=3 22 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br BB17-2779 [0,1,1,0,0,0|0,0,0]=2 23 B11R1.159 CC1=C(C(=O)O)C=CC=C1I BB17-2772 [0,1,1,0,0,0|0,0,0]=2 24 B11R1.159 CC1=CC=CC(C(=O)O)=C1O BB17-0688 [0,1,1,0,0,0|1,0,0]=3 25 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 BB17-0944 [0,1,1,0,0,0|1,0,0]=3 26 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 BB17-1915 [0,1,1,0,0,0|1,0,0]=3 27 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 BB01-8300 [0,1,1,0,0,0|1,0,0]=3 28 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 BB17-0943 [0,1,1,0,0,0|1,0,0]=3 29 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 BB01-8295 [0,1,1,0,0,0|2,0,0]=4 30 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 BB17-0401 [0,1,1,0,0,0|1,0,0]=3 31 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 BB17-0400 [0,1,1,0,0,0|1,0,0]=3 32 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 BB17-0402 [0,1,1,0,0,0|1,0,0]=3 33 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 BB17-0458 [0,1,1,0,0,0|1,0,0]=3 34 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 BB01-8304 [0,1,1,0,0,0|1,0,0]=3 35 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 BB17-0459 [0,1,1,0,0,0|1,0,0]=3 36 B11R2.10 NC1CC2=CC=CC=C2C1 BB53-1264 [1,1,0,0,0,0|1,0,1]=4 37 B11R2.10 O=C1CC2=C(C=CC=C2)C1 BB01-8363 [1,1,0,0,0,0|1,0,1]=4 38 B11R2.36 CC1=CC=C2NC=CC2=C1 BB01-8311 [1,1,0,0,0,0|2,0,0]=4 39 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 BB01-6108 [0,2,0,0,0,0|2,0,0]=4 40 B13R2.135 O=CC1=C(Cl)NC2=CC=CC=C21 BB17-2375 [0,2,0,0,0,0|2,0,0]=4 41 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BB17-2253 [0,2,0,0,0,0|2,0,0]=4 42 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O BB01-4994 [0,2,0,0,0,0|2,0,0]=4 43 B9R1.41 CC1=C(C(=O)O)OC=N1 BB01-8336 [0,0,1,0,1,0|2,0,0]=4 44 B11R1.86 CC(=O)NC1=CC=CC=C1O BB17-0735 [0,0,1,0,0,1|2,0,0]=4 45 B11R1.86 O=C(O)CC1=CC=CC=C1Cl BB01-6128 [0,0,1,0,0,1|1,0,0]=3