0 B11R1.166 CC1=CC=C(C(=O)O)C(O)=N1 SB01990 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.166 CC1=CC=C(C(N)=S)C(O)=N1 FM00043 [0,0,0,0,0,0|3,1,0]=4 2 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CD07981 [1,0,0,0,0,0|3,0,0]=4 3 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SPB06264 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.13 NC(=S)C1=CC=C(F)C=C1 SEW05679 [1,0,0,0,0,0|2,1,0]=4 5 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 RDP00161 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.61 O=C(O)C1=CC=CC=C1I BTB05694 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.61 O=C(O)C1=CC=CN=C1S SB00659 [1,0,0,0,0,0|1,1,0]=3 8 B12R1.232 CC(=O)C1=CC(F)=C(Cl)C=C1Cl BTB15028 [0,1,0,0,0,0|3,0,0]=4 9 B12R1.1000 CC(=O)C1=C(O)C=C(C)OC1=O RJC00983 [0,1,0,0,0,0|3,0,0]=4 10 B12R1.1000 CC1=C(C(=O)O)C(O)=NC(O)=C1 RF00769 [0,1,0,0,0,0|1,0,0]=2 11 B12R1.1000 CC1=CC(=O)OC(C)=C1C(=O)O KM09734 [0,1,0,0,0,0|2,0,1]=4 12 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(O)=N1 RF00089 [0,1,0,0,0,0|2,0,0]=3 13 B12R1.1703 C\C(=N/O)C1=CC=C(Cl)C=C1Cl KM06478 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1Cl BTB08025 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.1703 N\C(=N/O)C1=C(F)C=C(F)C=C1 MGH00219 [0,1,0,0,0,0|3,0,0]=4 16 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 RJC01116 [0,0,0,1,0,0|3,0,0]=4 17 B12R2.612 OC1=NOC2=C1C=CC(Cl)=C2 RF01288 [0,0,0,1,0,0|2,0,0]=3 18 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 BTB04571 [0,0,0,0,0,1|3,0,0]=4 19 B12R1.233 CC(=O)NC1=C(C)C=C(I)C=C1 RDP00225 [0,0,0,0,0,1|3,0,0]=4 20 B12R1.233 CC(=O)NC1=C(Cl)C=C(Br)C=C1 TL00885 [0,0,0,0,0,1|3,0,0]=4 21 B12R1.233 CC(=O)NC1=C(Cl)C=C(Cl)C=C1 TL00914 [0,0,0,0,0,1|3,0,0]=4 22 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 BTB03441 [0,0,0,0,0,1|3,0,0]=4 23 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1F BTB07539 [0,0,0,0,0,1|3,0,0]=4 24 B12R1.233 CC(=O)NC1=CC=C(C)C=C1C KM08882 [0,0,0,0,0,1|3,0,0]=4 25 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1C TL00898 [0,0,0,0,0,1|3,0,0]=4 26 B12R1.233 CC(=O)NC1=CC=C(F)C=C1Cl BTB05770 [0,0,0,0,0,1|3,0,0]=4 27 B12R1.233 CC1=CC(Cl)=CC=C1NC(N)=O JA00161 [0,0,0,0,0,1|3,0,0]=4 28 B12R1.233 NC(=O)CC1=C(Cl)C=C(F)C=C1 TL01011 [0,0,0,0,0,1|3,0,0]=4 29 B12R1.233 NC(=O)NC1=C(F)C=C(F)C=C1 KM10031 [0,0,0,0,0,1|3,0,0]=4 30 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 BTB09873 [1,1,0,0,0,0|1,0,0]=3 31 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 JFD03586 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 BTB13819 [1,1,0,0,0,0|0,0,0]=2 33 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 BTB10192 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 HTS13706 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 KM05492 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 BTB04111 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BTB04099 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 SPB06960 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 CD11832 [1,1,0,0,0,0|1,0,0]=3 40 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 HTS02459 [1,1,0,0,0,0|1,0,0]=3 41 B11R1.81 O\N=C\C1=CC=C(Cl)C=C1Cl SPB04865 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.53 COC1=NC=CC=C1C(=O)O KM01841 [1,1,0,0,0,0|1,0,0]=3 43 B11R1.53 CSC1=NC=CC=C1C(=O)O BTB06287 [1,1,0,0,0,0|1,1,0]=4 44 B11R1.156 O=C(O)C1=C(F)C=CC=C1F SB01105 [1,1,0,0,0,0|1,0,0]=3 45 B11R1.156 O=C(O)C1=C(I)C=CC=C1F TL00162 [1,1,0,0,0,0|1,0,0]=3 46 B11R1.159 CC1=CC=CC(C(=O)O)=C1F CD10965 [1,1,0,0,0,0|1,0,0]=3 47 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 BTB11559 [1,1,0,0,0,0|1,0,0]=3 48 B11R1.167 CC1=CC(C(N)=O)=C(I)C=C1 RJC00413 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.167 NC(=O)C1=C(I)C=CC(Cl)=C1 RJC00415 [1,1,0,0,0,0|2,0,0]=4 50 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 BTB11561 [1,1,0,0,0,0|1,0,0]=3 51 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1O SPB06836 [1,1,0,0,0,0|1,0,0]=3 52 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 NRB00705 [1,1,0,0,0,0|2,0,0]=4 53 B11R1.222 C\C(=N/O)C1=C(Cl)C=CC=C1 KM09168 [1,1,0,0,0,0|2,0,0]=4 54 B11R1.222 NNC(=O)C1=CC=CC=C1Br RDP00172 [1,1,0,0,0,0|2,0,0]=4 55 B11R1.222 NNC(=O)C1=CC=CC=C1O SEW04563 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.64 COC1=C(Br)SC=C1C(=O)O KM00596 [0,1,0,0,1,0|2,0,0]=4 57 B11R1.64 COC1=C(Cl)SC=C1C(=O)O KM00452 [0,1,0,0,1,0|2,0,0]=4 58 B11R1.865 COC(=O)C1=C(O)C(Br)=CS1 GK01940 [0,1,0,0,1,0|2,0,0]=4 59 B13R1.315 COC1=C(C(=O)O)C(C)=CC(C)=N1 RH02223 [0,2,0,0,0,0|2,0,0]=4 60 B13R1.120 O=C(O)C1=CC=C(C(=O)O)C(F)=C1 RDR03446 [0,2,0,0,0,0|1,0,0]=3 61 B13R1.1511 CCOC(=O)C1=CN=C(O)C=C1O SPB07340 [0,2,0,0,0,0|1,0,0]=3 62 B11R2.1 O=C1SNC2=CC=CC=C12 BTB03127 [1,0,0,1,0,0|1,1,0]=4 63 B9R1.35 O=C(O)C1=CC=C(Br)O1 AC10702 [1,0,0,0,1,0|2,0,0]=4 64 B9R1.35 O=C(O)C1=CC=C(Br)S1 BTB12643 [1,0,0,0,1,0|2,0,0]=4 65 B9R1.35 O=C(O)C1=CC=C(Cl)S1 KM03331 [1,0,0,0,1,0|2,0,0]=4 66 B9R1.41 O=C(O)C1=C(Br)C=CS1 SEW01838 [1,0,0,0,1,0|2,0,0]=4 67 B9R1.41 O=C(O)C1=C(Cl)C=CS1 GK01306 [1,0,0,0,1,0|2,0,0]=4 68 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 KM05555 [1,0,0,0,0,1|2,0,0]=4 69 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 DP01919 [1,0,0,0,0,1|2,0,0]=4 70 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 RH00230 [1,0,0,0,0,1|2,0,0]=4 71 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 MB00106 [1,0,0,0,0,1|1,0,0]=3 72 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 JA00151 [1,0,0,0,0,1|2,0,0]=4 73 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 S04036 [1,0,0,0,0,1|2,0,0]=4 74 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 TL00410 [1,0,0,0,0,1|1,0,0]=3 75 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 RH01845 [1,0,0,0,0,1|1,0,0]=3 76 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 NRB00708 [1,0,0,0,0,1|2,0,0]=4 77 B11R1.86 CC(=O)NC1=C(F)C=CC=C1 SPB06387 [1,0,0,0,0,1|2,0,0]=4 78 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 NRB00707 [1,0,0,0,0,1|2,0,0]=4 79 B11R1.86 O=C(O)CC1=CC=CC=C1I NRB00709 [1,0,0,0,0,1|1,0,0]=3 80 B11R1.74 CC1=CC(C(=O)O)=CC(O)=N1 MO00027 [0,0,0,0,1,1|2,0,0]=4 81 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CD11016 [0,0,0,0,1,1|2,0,0]=4 82 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 SB00524 [0,0,0,0,1,1|1,0,0]=3 83 B13R1.164 O=C(O)CCC1=CC=C(Cl)C=C1Cl SEW04678 [0,0,0,0,0,2|2,0,0]=4 84 B13R1.164 O=C(O)CSC1=CC=C(Cl)C=C1Cl BTB08747 [0,0,0,0,0,2|2,0,0]=4 85 B13R1.164 O=C(O)CSC1=CC=C(F)C=C1Cl BTB08730 [0,0,0,0,0,2|2,0,0]=4