0 B10R1.20 BrCC1=C(CBr)C=CC=C1 AMBZ0141 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.20 COC1=CC=CC=C1CBr AMBZ0001 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.20 N#CC1=C(CBr)C=CC=C1 AMBZ0155 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.15 BrCC1=C(I)C=CC=C1 AMBZ0166 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.15 C(=O)C1=CC=NC=C1Br AMPD00062 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.15 CC1=C(CN)C=CC=N1 AMPD00230 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.15 CC1=NC=CC=C1C#N AMPD00233 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.15 CCC1=C(O)C=CC=N1 AMPD00071 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.15 FC1=CC=CC=C1CBr AMBZ0151 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.15 NC1=C(CBr)C=CC=C1 AMBZ0032 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.15 NC1=CC=CC=C1CBr AMBZ0055 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.15 NCC1=C(O)C=NC=C1 AMPD00023 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.15 O=CC1=C(S)C=CC=C1 AMBZ0043 [1,0,0,0,0,0|0,1,0]=2 13 B11R1.37 COC1=C(OC)N=C(N)C=C1 AMPD00032 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.37 COC1=NC=C(Br)C=C1C=O AMPD00046 [0,1,0,0,0,0|1,0,0]=2 15 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 AMBZ0196 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.53 CSC1=C(B(O)O)C=CC=C1 AMBA00100 [0,1,0,0,0,0|1,1,1]=4 17 B11R1.53 O=C(O)C1=C(CBr)C=CC=C1 AMBZ0163 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 AMBZ0369 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.53 O=N(=O)C1=CC=CC=C1CBr AMBZ0158 [0,1,0,0,0,0|3,0,0]=4 20 B11R2.1 BrC1=CNC2=CC=CC=C12 AMOT0036 [0,0,0,1,0,0|2,0,1]=4 21 B11R2.1 NC1=CNC2=CC=CC=C12 AMOT0054 [0,0,0,1,0,0|2,0,1]=4 22 B11R2.1 O=C1CCC2=CC=CN=C12 AMPD00350 [0,0,0,1,0,0|2,0,0]=3 23 B11R2.20 C1=CC=C2COCCC2=C1 AMBZ0096 [0,0,0,1,0,0|1,0,2]=4 24 B9R1.14 CCN1C=CN=C1C=O AMOT0013 [0,0,0,0,1,0|3,0,0]=4 25 B8R1.2 CNC1=CC=NC=C1 AMPD00220 [2,0,0,0,0,0|2,0,0]=4 26 B8R1.2 O=CC1=CN=CN=C1 AMMD00015 [2,0,0,0,0,0|2,0,0]=4 27 B8R1.2 O=CC1=NC=CC=N1 AMMD00013 [2,0,0,0,0,0|2,0,0]=4 28 B8R1.5 CC1=C(Br)C=CN=C1 AMPD00146 [2,0,0,0,0,0|2,0,0]=4 29 B8R1.5 CC1=NC=CC=C1O AMPD00145 [2,0,0,0,0,0|1,0,1]=4 30 B8R1.5 NC1=C(O)C=NC=C1 AMPD00180 [2,0,0,0,0,0|2,0,0]=4 31 B8R1.5 OC1=C(O)C=NC=C1 AMPD00018 [2,0,0,0,0,0|1,0,1]=4 32 B10R1.2 CNC1=CC=CC(Br)=C1N AMBZ0292 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.2 COC1=CC=CC(Cl)=C1F AMBZ0017 [1,1,0,0,0,0|1,0,0]=3 34 B10R1.4 O=CCC1=C(Cl)C=CC=C1 AMBZ0299 [1,1,0,0,0,0|1,0,0]=3 35 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 AMBZ0332 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.25 COC1=C(C)C=C(Br)C=C1 AMBZ0178 [1,1,0,0,0,0|0,0,1]=3 37 B10R1.25 COC1=C(C)C=C(Br)C=N1 AMPD00266 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.30 CC1=CC(C=O)=C(N)N=C1 AMPD00112 [1,1,0,0,0,0|2,0,0]=4 39 B10R1.30 COC1=C(Br)C=CC(O)=C1 AMBZ0260 [1,1,0,0,0,0|1,0,0]=3 40 B10R1.30 COC1=CC(Br)=CN=C1N AMPD00058 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.30 COC1=CC(Cl)=CC=C1O AMBZ0243 [1,1,0,0,0,0|0,0,1]=3 42 B10R1.30 COC1=NC(Cl)=CC=C1Br AMPD00065 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.61 CC1=C(C(=O)O)N=CC=N1 AMPZ0024 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.61 CC1=NC=CC=C1C(=O)O AMPD00079 [1,1,0,0,0,0|1,0,0]=3 45 B10R1.61 CC1=NC=CC=C1C(N)=O AMPD00235 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.61 NC(=O)C1=CN=CC=C1Cl AMPD00144 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 AMPD00147 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.61 O=N(=O)C1=C(O)C=CN=C1 AMPD00059 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.61 OB(O)C1=C(O)C=CC=C1 AMBA00098 [1,1,0,0,0,0|1,0,1]=4 50 B10R1.245 O=CC1=C(Cl)N=CC=C1Cl AMPD00281 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.245 O=CC1=C(Cl)N=CC=C1I AMPD00265 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.46 CNC1=CC=C(F)C=C1N(=O)=O AMBZ0459 [0,2,0,0,0,0|2,0,0]=4 53 B12R1.57 COC1=C(C(=O)O)C=NC(Cl)=C1 AMPD00075 [0,2,0,0,0,0|1,0,0]=3 54 B12R1.57 O=CC1=CC(Br)=CC=C1N(=O)=O AMBZ0016 [0,2,0,0,0,0|2,0,0]=4 55 B12R1.78 CCC1=CC=C(OC)C=C1OC AMBZ0406 [0,2,0,0,0,0|1,0,1]=4 56 B12R1.75 CC(=O)NC1=CC=CC=C1CBr AMBZ0050 [0,2,0,0,0,0|2,0,0]=4 57 B12R1.75 COC1=CC=CC=C1CC(C)N AMBZ0414 [0,2,0,0,0,0|1,0,1]=4 58 B12R1.75 COC1=CC=CC=C1CC(C)N AMBZ0416 [0,2,0,0,0,0|1,0,1]=4 59 B12R1.75 COC1=CC=CC=C1C[C@@H](C)N AMBZ0409 [0,2,0,0,0,0|1,0,1]=4 60 B12R1.75 COC1=CC=CC=C1C[C@H](C)N AMBZ0417 [0,2,0,0,0,0|1,0,1]=4 61 B12R1.77 C#CC1=C(C(=O)OC)C=CC=C1 AMBZ0198 [0,2,0,0,0,0|1,0,1]=4 62 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 AMBZ0132 [0,2,0,0,0,0|1,0,1]=4 63 B12R1.121 COC1=CC=CC=C1C=CC=O AMBZ0228 [0,2,0,0,0,0|0,0,0]=2 64 B12R1.87 O=CC1=C(F)C=CC=C1B(O)O AMBA00039 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.437 COC1=C([C@@H](C)N)C(F)=CC=C1 AMBZ0420 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.437 COC1=C([C@H](C)N)C(F)=CC=C1 AMBZ0426 [0,2,0,0,0,0|1,0,1]=4 67 B10R1.176 COC1=CC(C)=C(Br)C=C1 AMBZ0127 [0,0,1,1,0,0|2,0,0]=4 68 B10R1.176 COC1=CC(O)=C(Br)C=C1 AMBZ0261 [0,0,1,1,0,0|1,0,1]=4 69 B10R2.7 C1=CC2=C(C=C1)NCC2 AMBZ0179 [1,0,0,1,0,0|1,0,1]=4 70 B10R2.7 C1=CC=C2CNCC2=C1 AMBZ0192 [1,0,0,1,0,0|1,0,1]=4 71 B12R2.132 CC1=CC=C2OCC(=O)C2=C1 AMOT0775 [0,1,0,1,0,0|0,0,0]=2 72 B12R2.132 NC1=CC2=C(C=C1)CCC2=O AMOT0820 [0,1,0,1,0,0|1,0,0]=3 73 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 AMOT0646 [0,1,0,1,0,0|1,0,0]=3 74 B12R2.132 O=C1CCC2=C1C=C(F)C=C2 AMOT0647 [0,1,0,1,0,0|1,0,0]=3 75 B12R2.132 O=C1CCC2=C1C=C(O)C=C2 AMOT0795 [0,1,0,1,0,0|1,0,0]=3 76 B12R2.132 O=C1COC2=CC=C(Br)C=C12 AMOT0776 [0,1,0,1,0,0|0,0,0]=2 77 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 AMOT0723 [0,1,0,1,0,0|0,0,0]=2 78 B12R2.132 O=C1COC2=CC=C(F)C=C12 AMOT0792 [0,1,0,1,0,0|0,0,0]=2 79 B12R2.132 O=C1OCC2=C1C=C(Br)C=C2 AMOT0681 [0,1,0,1,0,0|2,0,0]=4 80 B12R2.132 O=C1OCC2=C1C=C(Cl)C=C2 AMOT0683 [0,1,0,1,0,0|2,0,0]=4 81 B12R2.132 O=C1OCC2=C1C=C(F)C=C2 AMOT0697 [0,1,0,1,0,0|2,0,0]=4 82 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 AMOT0745 [0,1,0,1,0,0|1,0,0]=3 83 B12R2.612 CC1=CC2=C(C=C1)C(=O)CO2 AMOT0688 [0,1,0,1,0,0|0,0,0]=2 84 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 AMOT0732 [0,1,0,1,0,0|1,0,0]=3 85 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 AMOT0042 [0,1,0,1,0,0|2,0,0]=4 86 B12R2.612 O=C1COC2=CC(Br)=CC=C12 AMOT0686 [0,1,0,1,0,0|0,0,0]=2 87 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 AMOT0721 [0,1,0,1,0,0|0,0,0]=2 88 B12R2.612 O=C1OCC2=C1C=CC(F)=C2 AMOT0821 [0,1,0,1,0,0|2,0,0]=4 89 B12R2.315 CCC1=CC=CC2=C1NC=C2 AMBZ0215 [0,1,0,1,0,0|2,0,0]=4 90 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AMBZ0092 [0,1,0,1,0,0|0,0,0]=2 91 B12R2.196 CC1=CC=CC2=C1CCC2=O AMOT0699 [0,1,0,1,0,0|1,0,0]=3 92 B12R2.196 CC1=CC=CC2=C1OCC2=O AMOT0802 [0,1,0,1,0,0|0,0,0]=2 93 B12R2.196 O=C1CCC2=C1C=CC=C2Br AMOT0652 [0,1,0,1,0,0|1,0,0]=3 94 B12R2.196 O=C1CCC2=C1C=CC=C2Cl AMOT0651 [0,1,0,1,0,0|1,0,0]=3 95 B12R2.196 O=C1CCC2=C1C=CC=C2F AMOT0819 [0,1,0,1,0,0|1,0,0]=3 96 B12R2.196 O=C1COC2=C(Br)C=CC=C12 AMOT0764 [0,1,0,1,0,0|0,0,0]=2 97 B12R2.196 O=C1COC2=C(F)C=CC=C12 AMOT0722 [0,1,0,1,0,0|0,0,0]=2 98 B12R2.196 O=C1OCC2=C1C=CC=C2Cl AMOT0766 [0,1,0,1,0,0|2,0,0]=4 99 B12R2.203 CC1=CC=CC2=C1C(=O)CC2 AMOT0737 [0,1,0,1,0,0|1,0,0]=3 100 B12R2.203 N[C@H]1COC2=CC=CC(F)=C21 AMGLY00061 [0,1,0,1,0,0|1,0,1]=4 101 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 AMOT0596 [0,1,0,1,0,0|1,0,0]=3 102 B12R2.203 O=C1CCC2=C1C(F)=CC=C2 AMOT0798 [0,1,0,1,0,0|1,0,0]=3 103 B12R2.203 O=C1OCC2=C1C(Cl)=CC=C2 AMOT0822 [0,1,0,1,0,0|2,0,0]=4 104 B8R1.11 CC1=NNC=C1C=O AMOT0271 [1,0,0,0,1,0|2,0,0]=4 105 B8R1.11 CN1N=CC=C1C=O AMOT0219 [1,0,0,0,1,0|2,0,0]=4