0 B9R1.8 CNCC1=CC=CN=C1 AMPD00053 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.8 N#CCC1=CC=CN=C1 AMPD00252 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.8 ONCC1=CC=CC=C1 AMBZ0382 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.2 CNC1=CC=NC=C1 AMPD00220 [1,0,0,0,0,0|2,0,0]=3 4 B8R1.2 ClCC1=NC=CC=N1 AMMD00055 [1,0,0,0,0,0|3,0,0]=4 5 B8R1.2 NCC1=CC=NC=C1 AMPD00212 [1,0,0,0,0,0|1,0,0]=2 6 B8R1.2 NCC1=CC=NC=C1 AMPD00214 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.4 O=CCC1=C(Cl)C=CC=C1 AMBZ0299 [0,1,0,0,0,0|1,0,1]=3 8 B10R1.15 CC(CS)C1=CC=CC=C1 AMBZ0298 [0,1,0,0,0,0|1,0,0]=2 9 B10R1.15 N[C@@H](CO)C1=CC=CN=C1 AMPD00296 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.15 O=C(CF)C1=CC=CC=C1 AMBZ0003 [0,1,0,0,0,0|1,0,1]=3 11 B10R1.17 NCCSC1=CC=NC=C1 AMPD00068 [0,1,0,0,0,0|1,0,0]=2 12 B10R1.17 O=C=NCC1=CC=CC=C1 AMBZ0271 [0,1,0,0,0,0|1,0,1]=3 13 B10R1.18 NC(=O)CC1=CC=CN=C1 AMPD00251 [0,1,0,0,0,0|1,0,1]=3 14 B10R1.18 NC(=S)NC1=CC=CC=N1 AMPD00167 [0,1,0,0,0,0|2,0,1]=4 15 B10R2.7 C1=CC2=C(C=C1)NCC2 AMBZ0179 [0,0,0,1,0,0|0,0,0]=1 16 B10R2.7 C1=CC2=C(C=N1)NC=C2 AMOT0019 [0,0,0,1,0,0|1,0,2]=4 17 B10R2.7 C1=CC=C2CNCC2=C1 AMBZ0192 [0,0,0,1,0,0|2,0,0]=3 18 B7R1.3 NC1=CC=NC=C1 AMPD00207 [2,0,0,0,0,0|1,0,0]=3 19 B9R1.1 BrCC1=CC=C(I)C=C1 AMBZ0168 [1,1,0,0,0,0|1,0,0]=3 20 B9R1.1 CC1=CC=C(CBr)C=N1 AMPD00037 [1,1,0,0,0,0|2,0,0]=4 21 B9R1.1 CC1=CC=C(CBr)C=N1 AMPD00038 [1,1,0,0,0,0|2,0,0]=4 22 B9R1.1 CC1=CC=C(CO)C=N1 AMPD00039 [1,1,0,0,0,0|2,0,0]=4 23 B9R1.1 CCC1=NC=C(Br)C=N1 AMMD00003 [1,1,0,0,0,0|2,0,0]=4 24 B9R1.1 COC1=CC=C(O)C=N1 AMPD00162 [1,1,0,0,0,0|2,0,0]=4 25 B9R1.1 COC1=NC=C(Br)C=C1 AMPD00190 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.1 FC1=CC=C(CBr)C=C1 AMBZ0153 [1,1,0,0,0,0|1,0,0]=3 27 B9R1.1 N#CC1=CC=C(S)C=C1 AMBZ0044 [1,1,0,0,0,0|0,0,2]=4 28 B9R1.1 NCC1=CC=C(Br)C=C1 AMBZ0458 [1,1,0,0,0,0|0,0,0]=2 29 B9R1.1 NCC1=CC=C(O)C=C1 AMBZ0457 [1,1,0,0,0,0|0,0,0]=2 30 B9R1.2 BrCC1=CC(I)=CC=C1 AMBZ0167 [1,1,0,0,0,0|1,0,0]=3 31 B9R1.2 ClC1=NC=CC(CBr)=C1 AMPD00201 [1,1,0,0,0,0|2,0,0]=4 32 B9R1.2 FC1=CC=CC(CBr)=C1 AMBZ0152 [1,1,0,0,0,0|1,0,0]=3 33 B9R1.2 NNC1=CC(Cl)=NC=C1 AMPD00345 [1,1,0,0,0,0|2,0,0]=4 34 B9R1.6 C[C@@H](N)C1=CN=CN=C1 AMMD00053 [1,1,0,0,0,0|2,0,0]=4 35 B9R1.6 C[C@H](N)C1=CN=CN=C1 AMMD00052 [1,1,0,0,0,0|2,0,0]=4 36 B9R1.6 NC(=O)C1=CC=CC=N1 AMPD00164 [1,1,0,0,0,0|1,0,1]=4 37 B9R1.15 BrCC1=C(I)C=CC=C1 AMBZ0166 [1,1,0,0,0,0|1,0,0]=3 38 B9R1.15 CC1=C(CN)C=CC=N1 AMPD00230 [1,1,0,0,0,0|1,0,0]=3 39 B9R1.15 CCC1=C(O)C=CC=N1 AMPD00071 [1,1,0,0,0,0|1,0,0]=3 40 B9R1.15 FC1=CC=CC=C1CBr AMBZ0151 [1,1,0,0,0,0|1,0,0]=3 41 B9R1.15 FC1=NC=CC=C1CBr AMPD00073 [1,1,0,0,0,0|2,0,0]=4 42 B9R1.15 NC1=C(CBr)C=CC=C1 AMBZ0032 [1,1,0,0,0,0|1,0,0]=3 43 B9R1.15 NC1=CC=CC=C1CBr AMBZ0055 [1,1,0,0,0,0|1,0,0]=3 44 B9R1.15 NCC1=C(O)C=NC=C1 AMPD00023 [1,1,0,0,0,0|1,0,0]=3 45 B9R1.15 NCC1=CN=CC=C1Cl AMPD00226 [1,1,0,0,0,0|1,0,0]=3 46 B9R1.15 O=CC1=C(S)C=CC=C1 AMBZ0043 [1,1,0,0,0,0|1,0,1]=4 47 B9R1.15 OCC1=C(Br)C=NC=C1 AMPD00031 [1,1,0,0,0,0|2,0,0]=4 48 B11R1.22 N#C[C@H](N)C1=CC=C(F)C=C1 AMOT0900 [0,2,0,0,0,0|0,0,2]=4 49 B11R1.22 N#C[C@H](N)C1=CC=C(N)C=C1 AMOT0899 [0,2,0,0,0,0|0,0,2]=4 50 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 AMGLY00149 [0,2,0,0,0,0|1,0,0]=3 51 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 AMGLY00240 [0,2,0,0,0,0|1,0,0]=3 52 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AMGLY00020 [0,2,0,0,0,0|1,0,0]=3 53 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 AMGLY00054 [0,2,0,0,0,0|1,0,0]=3 54 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 AMGLY00142 [0,2,0,0,0,0|1,0,0]=3 55 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 AMGLY00021 [0,2,0,0,0,0|1,0,0]=3 56 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 AMBZ0029 [0,2,0,0,0,0|1,0,1]=4 57 B11R1.222 N[C@H](CO)C1=CC=CC=C1F AMGLY00085 [0,2,0,0,0,0|1,0,0]=3 58 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 AMOT0486 [0,2,0,0,0,0|1,0,0]=3 59 B11R1.23 NC(CO)C1=CC(Br)=CC=C1 AMGLY00025 [0,2,0,0,0,0|1,0,0]=3 60 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 AMGLY00026 [0,2,0,0,0,0|1,0,0]=3 61 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 AMGLY00027 [0,2,0,0,0,0|1,0,0]=3 62 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 AMGLY00029 [0,2,0,0,0,0|1,0,0]=3 63 B11R1.23 NC(CO)C1=CC=CC(F)=C1 AMGLY00139 [0,2,0,0,0,0|1,0,0]=3 64 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 AMGLY00003 [0,2,0,0,0,0|1,0,0]=3 65 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 AMGLY00002 [0,2,0,0,0,0|1,0,0]=3 66 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 AMGLY00028 [0,2,0,0,0,0|1,0,0]=3 67 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 AMGLY00005 [0,2,0,0,0,0|1,0,0]=3 68 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 AMGLY00004 [0,2,0,0,0,0|1,0,0]=3 69 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 AMGLY00030 [0,2,0,0,0,0|1,0,0]=3 70 B11R1.24 COCOC1=CC(Br)=CC=C1 AMBZ0339 [0,2,0,0,0,0|2,0,0]=4 71 B11R1.16 N#CCC(=O)C1=CC=CC=C1 AMBZ0088 [0,2,0,0,0,0|0,0,2]=4 72 B11R1.40 COC(=N)CC1=CC=CC=C1 AMBZ0305 [0,2,0,0,0,0|0,0,2]=4 73 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 AMBZ0200 [0,1,0,1,0,0|1,0,1]=4 74 B11R2.36 BrC1=CC=C2NC=CC2=C1 AMBZ0191 [0,1,0,1,0,0|0,0,2]=4 75 B11R2.36 BrC1=CC=C2NCCC2=C1 AMBZ0135 [0,1,0,1,0,0|0,0,0]=2 76 B11R2.36 BrC1=CC=C2NN=CC2=C1 AMBZ0279 [0,1,0,1,0,0|1,0,1]=4 77 B11R2.36 CC1=CC2=C(C=C1)C=NN2 AMBZ0278 [0,1,0,1,0,0|1,0,1]=4 78 B11R2.36 CC1=CC2=C(C=C1)NN=C2 AMBZ0277 [0,1,0,1,0,0|1,0,1]=4 79 B11R2.36 CC1=CC=C2NC=CC2=C1 AMBZ0187 [0,1,0,1,0,0|0,0,2]=4 80 B11R2.36 ClC1=CC=C2NC=CC2=C1 AMBZ0134 [0,1,0,1,0,0|0,0,2]=4 81 B11R2.36 NC1=CC=C2C=CNC2=C1 AMBZ0139 [0,1,0,1,0,0|0,0,2]=4 82 B11R2.36 NC1=CC=C2NC=CC2=C1 AMBZ0138 [0,1,0,1,0,0|0,0,2]=4 83 B11R2.20 C1=CC=C2COCCC2=C1 AMBZ0096 [0,1,0,1,0,0|1,0,0]=3 84 B11R2.55 BrC1=C(C2CC2)C=CC=C1 AMBZ0302 [0,1,0,1,0,0|1,0,0]=3 85 B11R2.106 BrC1=C2C=CNC2=CC=C1 AMOT0049 [0,1,0,1,0,0|0,0,2]=4 86 B11R2.106 CC1=C2NC=CC2=CC=C1 AMBZ0214 [0,1,0,1,0,0|0,0,2]=4 87 B11R2.106 ClC1=C2NC=CC2=CC=C1 AMBZ0213 [0,1,0,1,0,0|0,0,2]=4 88 B11R2.106 NC1=C2N=CNC2=CC=C1 AMBZ0119 [0,1,0,1,0,0|1,0,1]=4 89 B11R2.1 BrC1=CNC2=CC=CC=C12 AMOT0036 [0,1,0,1,0,0|0,0,2]=4 90 B11R2.1 NC1=CNC2=CC=CC=C12 AMOT0054 [0,1,0,1,0,0|0,0,2]=4 91 B11R2.1 N[C@@H]1CCC2=C1C=NC=C2 AMPD00295 [0,1,0,1,0,0|1,0,0]=3 92 B11R2.1 O=C1CCC2=CC=CN=C12 AMPD00350 [0,1,0,1,0,0|2,0,0]=4 93 B11R2.1 OC1CCC2=CC=CN=C21 AMPD00349 [0,1,0,1,0,0|2,0,0]=4 94 B11R2.239 C1=CC=C(C2COC2)C=C1 AMOT00010 [0,1,0,1,0,0|1,0,0]=3 95 B7R1.1 BrCC1=CSC=C1 AMOT0247 [1,0,0,0,1,0|2,0,0]=4 96 B7R1.1 NCC1=CNN=C1 AMOT0088 [1,0,0,0,1,0|2,0,0]=4 97 B7R1.1 OCC1=COC=C1 AMOT0242 [1,0,0,0,1,0|2,0,0]=4