0 B13R2.435 CC(C)C1=NC2=CC=CC=C2N1 EiM08-19247 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.435 CC(N)C1=NC2=C(C=CC=C2)N1 EiM18-01136 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 EiM18-02213 [0,0,0,0,0,0|1,0,0]=1 3 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 EiM18-02338 [0,0,0,0,0,0|0,0,0]=0 4 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 EiM18-01143 [1,0,0,0,0,0|2,0,1]=4 5 B12R2.32 NCC1=NC2=CC=CC=C2N1 EiM18-03017 [1,0,0,0,0,0|2,0,1]=4 6 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 EiM18-01928 [0,1,0,0,0,0|1,0,0]=2 7 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 EiM18-02898 [0,1,0,0,0,0|0,0,0]=1 8 B14R2.450 NC1=C(C(=O)O)SC2=NC=CC=C21 EiM08-20975 [0,1,0,0,0,0|2,0,0]=3 9 B14R2.972 COC(=O)C1=CC2=CC=CC=C2N1 EiM19-00771 [0,1,0,0,0,0|0,0,0]=1 10 B14R2.4529 CC1=CC2=NC(C(=O)O)=CN2C=C1 EiM08-05887 [0,1,0,0,0,0|1,0,1]=3 11 B14R2.4529 CC1=CN2C=C(C(=O)O)N=C2C=C1 EiM08-41816 [0,1,0,0,0,0|1,0,1]=3 12 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 EiM17-02510 [0,1,0,0,0,0|1,0,0]=2 13 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 EiM18-02321 [0,1,0,0,0,0|0,0,0]=1 14 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 EiM08-42910 [0,1,0,0,0,0|1,0,0]=2 15 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2S1 EiM08-42906 [0,1,0,0,0,0|1,0,0]=2 16 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 EiM08-42909 [0,1,0,0,0,0|1,0,0]=2 17 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2S1 EiM08-42907 [0,1,0,0,0,0|1,0,0]=2 18 B14R2.4529 O=C(O)C1=CN2C=C(Cl)C=CC2=N1 EiM08-05441 [0,1,0,0,0,0|1,0,1]=3 19 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2N1 EiM18-02315 [0,1,0,0,0,0|0,0,0]=1 20 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2S1 EiM08-42905 [0,1,0,0,0,0|1,0,0]=2 21 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 EiM08-42908 [0,1,0,0,0,0|1,0,0]=2 22 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 EiM08-41751 [0,0,1,0,0,0|1,0,2]=4 23 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 EiM17-03285 [0,0,1,0,0,0|1,0,2]=4 24 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2N1 EiM19-00950 [0,0,0,0,0,1|1,0,0]=2 25 B14R2.781 O=C(O)C1=CC2=C(C=C1)N=CC=N2 EiM18-02030 [0,0,0,0,0,1|3,0,0]=4 26 B14R2.781 O=C(O)C1COC2=C(C=CC=C2)O1 EiM18-02683 [0,0,0,0,0,1|1,0,2]=4 27 B11R1.91 O=C(O)CCC1=CC=CC=C1 EiM18-02113 [1,0,1,0,0,0|0,0,2]=4 28 B11R1.91 O=C(O)COC1=CC=CC=C1 EiM18-01962 [1,0,1,0,0,0|1,0,1]=4 29 B13R1.148 NC(CC1=CC(F)=CC=C1)C(=O)O EiM17-02856 [0,1,1,0,0,0|0,0,2]=4 30 B13R2.43 NC1=CC2=C(C=C1)NC(CO)=N2 EiM18-03341 [1,1,0,0,0,0|1,0,1]=4 31 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 EiM19-01195 [1,1,0,0,0,0|0,0,0]=2 32 B15R2.629 O=C(O)CN1CC2=CC=CC=C2C1=O EiM18-03415 [0,1,0,0,0,1|2,0,0]=4 33 B15R2.629 O=C(O)CN1NC2=CC=CC=C2C1=O EiM08-13993 [0,1,0,0,0,1|1,0,0]=3 34 B15R2.629 O=C(O)CN1SC2=C(C=CC=C2)C1=O EiM18-00850 [0,1,0,0,0,1|2,0,0]=4 35 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2N=C1 EiM08-43106 [0,1,0,0,0,1|0,0,1]=3 36 B15R2.627 O=C(O)C1=CNC2=C(C=CC=C2)C1=O EiM18-01937 [0,1,0,0,0,1|0,0,0]=2 37 B15R2.984 CC1=NC2=CC=CC=C2N=C1C(=O)O EiM08-41790 [0,1,0,0,0,1|0,0,1]=3 38 B15R2.984 O=C(O)C1=CC2=C(C=CC=C2)OC1=O EiM18-02820 [0,1,0,0,0,1|1,0,0]=3 39 B15R2.14951 O=C(O)C1=CC2=CC=CC=C2C(=O)S1 EiM17-02657 [0,1,0,0,0,1|1,0,0]=3 40 B15R2.1592 COC(=O)C1=C(N)C2=C(C=CC=C2)S1 EiM19-00288 [0,2,0,0,0,0|1,0,0]=3 41 B15R2.1592 COC(=O)C1=CC2=CC=CC=C2N1C EiM08-25397 [0,2,0,0,0,0|0,0,0]=2 42 B15R2.4190 O=CC1=C(C(=O)O)NC2=CC=CC=C21 EiM08-42830 [0,2,0,0,0,0|0,0,0]=2 43 B15R2.7203 CC1=C(C(=O)O)NC2=C1C=C(Br)C=C2 EiM18-02323 [0,2,0,0,0,0|0,0,0]=2 44 B15R2.7203 CN1C(C(=O)O)=CC2=CC=C(Cl)C=C21 EiM18-02320 [0,2,0,0,0,0|0,0,0]=2 45 B15R2.13463 CN1C(C(=O)O)=CC2=C(Cl)C=CC=C21 EiM18-02319 [0,2,0,0,0,0|0,0,0]=2 46 B15R2.14758 CN1C(C(=O)O)=CC2=CC(Cl)=CC=C21 EiM18-02305 [0,2,0,0,0,0|0,0,0]=2 47 B15R2.14758 CN1C(C(=O)O)=CC2=CC(F)=CC=C21 EiM18-03043 [0,2,0,0,0,0|0,0,0]=2 48 B15R2.4834 COC1=CC2=C(C=C1)C=C(C(=O)O)N2 EiM18-01900 [0,2,0,0,0,0|0,0,0]=2 49 B15R2.4834 COC1=CC2=C(C=C1)NC(C(=O)O)=C2 EiM18-01026 [0,2,0,0,0,0|0,0,0]=2 50 B15R2.4834 COC1=CC=C2C=C(C(=O)O)SC2=C1 EiM18-02549 [0,2,0,0,0,0|1,0,0]=3 51 B15R2.20824 COC1=C2C=C(C(=O)O)NC2=CC=C1 EiM08-42820 [0,2,0,0,0,0|0,0,0]=2 52 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 EiM18-02595 [0,0,1,1,0,0|2,0,0]=4 53 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 EiM18-02735 [0,0,1,1,0,0|1,0,1]=4 54 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 EiM18-02334 [0,0,1,1,0,0|2,0,0]=4 55 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 EiM18-02339 [0,0,1,1,0,0|2,0,0]=4 56 B13R2.5569 O=C(O)C1=C2NC=CC2=CC=C1 EiM18-02332 [0,0,1,1,0,0|2,0,0]=4 57 B13R2.5569 O=C(O)C1=CC=CC2=C1C=CN2 EiM18-02340 [0,0,1,1,0,0|2,0,0]=4 58 B15R3.2249 O=C1CCC2=C1NC3=CC=CC=C32 EiM08-21078 [0,1,0,1,0,0|1,0,0]=3 59 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 EiM19-01183 [1,0,0,0,0,1|0,0,1]=3 60 B15R2.1660 O=C(O)CCC1=NC2=C(C=CC=C2)N1 EiM17-02490 [0,0,0,0,0,2|1,0,0]=3 61 B15R2.1660 O=C(O)CCC1=NC2=CC=CC=C2S1 EiM08-09851 [0,0,0,0,0,2|1,0,1]=4 62 B15R2.1660 O=C(O)CSC1=NC2=CC=CC=C2N1 EiM08-21215 [0,0,0,0,0,2|1,0,0]=3