0 B9R1.6 NC(=O)C1=CC=CC=N1 AMPD00164 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.6 NC(=O)C1=NC=CC=N1 AMMD00047 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 O=C(Cl)C1=CC=CC=N1 AMPD00171 [0,0,0,0,0,0|1,0,0]=1 3 B8R1.2 CNC1=CC=NC=C1 AMPD00220 [1,0,0,0,0,0|3,0,0]=4 4 B8R1.2 ClCC1=NC=CC=N1 AMMD00055 [1,0,0,0,0,0|2,0,1]=4 5 B8R1.2 O=CC1=CN=CN=C1 AMMD00015 [1,0,0,0,0,0|3,0,0]=4 6 B8R1.2 O=CC1=NC=CC=N1 AMMD00013 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AMPD00159 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AMPD00158 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.13 CC1=CC=C(C(N)=O)C=N1 AMPD00206 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.13 CC1=CN=C(C(=O)O)C=N1 AMPZ0023 [0,1,0,0,0,0|2,0,0]=3 11 B10R1.13 NC(=O)C1=CC=C(Cl)N=N1 AMOT0100 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 AMPD00110 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 AMPD00160 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 AMOT0095 [0,1,0,0,0,0|2,0,0]=3 15 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 AMPZ0015 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.13 O=C(O)C1=CN=C(O)C=N1 AMPZ0014 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 AMPZ0019 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.15 CC(CS)C1=CC=CC=C1 AMBZ0298 [0,1,0,0,0,0|1,1,1]=4 19 B10R1.15 O=C(CF)C1=CC=CC=C1 AMBZ0003 [0,1,0,0,0,0|1,0,0]=2 20 B10R1.61 CC1=C(C(=O)O)N=CC=N1 AMPZ0024 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.61 CC1=NC=CC=C1C(=O)O AMPD00079 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.61 CC1=NC=CC=C1C(N)=O AMPD00235 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.61 NC(=O)C1=CN=CC=C1Cl AMPD00144 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 AMPD00147 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.61 O=C(O)C1=C(Cl)N=CC=N1 AMPZ0010 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 AMBZ0268 [0,1,0,0,0,0|1,0,0]=2 27 B10R1.113 CC(N)C1=NC(Br)=CC=C1 AMPD00303 [0,1,0,0,0,0|1,0,1]=3 28 B10R1.113 CC1=CC(C(=O)O)=CC=N1 AMPD00036 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.113 CC1=CC=CC(C(=O)O)=N1 AMPD00043 [0,1,0,0,0,0|1,0,0]=2 30 B10R1.113 CC1=CN=CC(C(=O)O)=N1 AMPZ0022 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.113 C[C@H](N)C1=CC(N)=CC=C1 AMOT0719 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AMOT0637 [0,1,0,0,0,0|2,0,1]=4 33 B10R1.113 NC(=O)C1=CN=CC(O)=C1 AMPD00082 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.113 NC1=CC(N(=O)=O)=NC=C1 AMPD00049 [0,1,0,0,0,0|2,0,0]=3 35 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 AMPD00035 [0,1,0,0,0,0|1,0,0]=2 36 B8R1.7 CC(=O)C1=NC=CO1 AMOT0351 [0,0,0,0,1,0|1,0,0]=2 37 B8R1.7 NC(=O)C1=CC=NO1 AMOT0325 [0,0,0,0,1,0|3,0,0]=4 38 B8R1.7 O=C(O)C1=COC=C1 AMOT0241 [0,0,0,0,1,0|2,0,0]=3 39 B8R1.7 O=C(O)C1=NC=CO1 AMOT0347 [0,0,0,0,1,0|2,0,0]=3 40 B8R1.7 O=N(=O)C1=CC=CO1 AMOT0097 [0,0,0,0,1,0|3,0,0]=4 41 B10R1.18 NC(=O)CC1=CC=CN=C1 AMPD00251 [0,0,0,0,0,1|3,0,0]=4 42 B10R1.18 NC(=S)NC1=CC=CC=N1 AMPD00167 [0,0,0,0,0,1|1,1,0]=3 43 B7R1.3 BrC1=NC=NC=C1 AMMD00029 [2,0,0,0,0,0|2,0,0]=4 44 B7R1.3 IC1=NC=CN=C1 AMPZ0008 [2,0,0,0,0,0|2,0,0]=4 45 B7R1.3 O=C1C=CC=NN1 AMOT0201 [2,0,0,0,0,0|1,0,1]=4 46 B9R1.1 C#CC1=CC=C(Br)C=N1 AMPD00115 [1,1,0,0,0,0|0,0,2]=4 47 B9R1.1 CCC1=NC=C(Br)C=N1 AMMD00003 [1,1,0,0,0,0|1,0,1]=4 48 B9R1.1 COC1=CC=C(O)C=N1 AMPD00162 [1,1,0,0,0,0|1,0,0]=3 49 B9R1.1 COC1=NC=C(Br)C=C1 AMPD00190 [1,1,0,0,0,0|1,0,0]=3 50 B9R1.1 COC1=NC=C(F)C=N1 AMMD00012 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.1 N#CC1=NC=C(Cl)C=C1 AMPD00140 [1,1,0,0,0,0|1,0,1]=4 52 B9R1.1 O=CC1=NC=C(Br)C=C1 AMPD00055 [1,1,0,0,0,0|0,0,0]=2 53 B9R1.2 N#CC1=NC=CC(Cl)=C1 AMPD00163 [1,1,0,0,0,0|1,0,1]=4 54 B9R1.2 O=CC1=CC(Cl)=NC=C1 AMPD00168 [1,1,0,0,0,0|2,0,0]=4 55 B9R1.15 C(=O)C1=CC=NC=C1Br AMPD00062 [1,1,0,0,0,0|2,0,0]=4 56 B9R1.15 CCC1=C(O)C=CC=N1 AMPD00071 [1,1,0,0,0,0|0,0,1]=3 57 B9R1.15 O=CC1=C(S)C=CC=C1 AMBZ0043 [1,1,0,0,0,0|1,0,0]=3 58 B9R1.35 CC(=O)C1=CN(C)N=C1 AMOT0089 [0,1,0,0,1,0|2,0,0]=4 59 B9R1.35 CC1=CC(C(=O)O)=NO1 AMOT0306 [0,1,0,0,1,0|2,0,0]=4 60 B9R1.35 CC1=NC(C(N)=O)=CO1 AMOT0287 [0,1,0,0,1,0|2,0,0]=4 61 B11R1.20 CC1=CC=C(CC(=O)O)N=C1 AMPD00137 [0,1,0,0,0,1|1,0,0]=3 62 B11R1.40 COC(=N)CC1=CC=CC=C1 AMBZ0305 [0,1,0,0,0,1|2,0,0]=4 63 B11R1.40 COC(=O)CC1=CC=CC=N1 AMPD00225 [0,1,0,0,0,1|0,0,0]=2 64 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 AMBZ0197 [0,2,0,0,0,0|2,0,0]=4 65 B11R1.3 COC1=NC=C(C(=O)O)N=C1 AMPZ0017 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 AMBZ0165 [0,2,0,0,0,0|2,0,0]=4 67 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 AMBZ0473 [0,2,0,0,0,0|2,0,0]=4 68 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 AMBZ0460 [0,2,0,0,0,0|2,0,0]=4 69 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 AMOT0099 [0,2,0,0,0,0|1,0,0]=3 70 B11R1.22 COC(=O)C1=CC=C(N)C=N1 AMPD00019 [0,2,0,0,0,0|0,0,0]=2 71 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 AMPZ0013 [0,2,0,0,0,0|1,0,0]=3 72 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 AMPZ0012 [0,2,0,0,0,0|1,0,0]=3 73 B11R1.22 COC(=O)C1=NC=C(C)N=C1 AMPZ0029 [0,2,0,0,0,0|1,0,0]=3 74 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 AMBZ0029 [0,2,0,0,0,0|1,0,0]=3 75 B11R1.166 CC(=O)C1=CC=C(C)C=C1O AMBZ0314 [0,2,0,0,0,0|1,0,0]=3 76 B11R1.166 CC1=CC(F)=CC=C1C(=O)O AMBZ0018 [0,2,0,0,0,0|2,0,0]=4 77 B11R1.166 NC(=O)C1=NC=C(Cl)N=C1Cl AMPZ0026 [0,2,0,0,0,0|2,0,0]=4 78 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 AMBZ0023 [0,2,0,0,0,0|2,0,0]=4 79 B11R1.16 N#CCC(=O)C1=CC=CC=C1 AMBZ0088 [0,2,0,0,0,0|1,0,0]=3 80 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 AMPD00128 [0,2,0,0,0,0|2,0,0]=4 81 B11R1.23 COC(=O)C1=NC(C)=CN=C1 AMPZ0030 [0,2,0,0,0,0|1,0,0]=3 82 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 AMBZ0056 [0,2,0,0,0,0|1,0,0]=3 83 B11R1.222 COC(=O)C1=CC=CN=C1C AMPD00078 [0,2,0,0,0,0|2,0,0]=4 84 B11R1.222 COC(=O)C1=NC=CN=C1C AMPZ0002 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 AMBZ0456 [0,2,0,0,0,0|2,0,0]=4 86 B11R1.155 CP(C)(=O)C1=CC=CC(Br)=C1 AMBZ0491 [0,2,0,0,0,0|2,0,0]=4 87 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 AMBZ0196 [0,2,0,0,0,0|2,0,0]=4 88 B11R1.53 O=C(O)C1=C(CBr)C=CC=C1 AMBZ0163 [0,2,0,0,0,0|2,0,0]=4 89 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 AMBZ0445 [0,2,0,0,0,0|2,0,0]=4 90 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F AMBZ0009 [0,2,0,0,0,0|1,0,0]=3 91 B11R1.167 CC(=O)C1=CC(F)=CC=C1O AMBZ0424 [0,2,0,0,0,0|1,0,0]=3 92 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=C1 AMBZ0036 [0,2,0,0,0,0|2,0,0]=4 93 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 AMBZ0024 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.74 NC1=NC(C(=O)O)=CC(Br)=C1 AMPD00260 [0,2,0,0,0,0|1,0,0]=3 95 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 AMBZ0164 [0,2,0,0,0,0|2,0,0]=4 96 B11R2.1 CC1=NNC2=CC=CN=C21 AMPD00022 [0,1,0,1,0,0|1,0,0]=3 97 B11R2.1 O=C1CCC2=CC=CN=C12 AMPD00350 [0,1,0,1,0,0|0,0,0]=2 98 B11R2.1 OC1CCC2=CC=CN=C21 AMPD00349 [0,1,0,1,0,0|0,0,2]=4 99 B7R1.1 O=CC1=CN=CS1 AMOT0280 [1,0,0,0,1,0|2,0,0]=4 100 B7R1.1 O=CC1=COC=C1 AMOT0244 [1,0,0,0,1,0|1,0,0]=3 101 B7R1.1 O=CC1=CSC=N1 AMOT0279 [1,0,0,0,1,0|1,0,0]=3 102 B7R1.1 O=CC1=NC=CO1 AMOT0346 [1,0,0,0,1,0|1,0,0]=3 103 B11R1.91 O=C(O)CCC1=NC=NC=C1 AMMD00004 [0,0,0,0,0,2|2,0,0]=4