aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42891 | 1.99 | 337.36 | C18H17O3N4 | COc1ccc(OCc2ccccc2)c(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD42892 | 2.95 | 288.37 | C15H16O2N2S | COc1cccc(CCC(=O)Nc2ccc(S)cc2)n1 |
|
AD42893 | 1.76 | 335.34 | C18H15O3N4 | NC(=O)C1=C(Nc2ccc(C(=O)OCc3ccccc3)cc2)[N]C=N1 |
|
AD42894 | 2.69 | 296.31 | C15H14O2N5 | CC(C)OC(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42895 | 2.43 | 297.3 | C14H13O2N6 | CCOc1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42896 | 2.59 | 351.21 | C12H9ON5SBr | CS(=O)c1ccccc1Nc1ncnc2c1N=C(Br)[N]2 |
|
AD42897 | 2.5 | 296.31 | C15H14O2N5 | CC(=O)OCc1cccc(C)c1Nc1ncnc2c1N=C[N]2 |
|
AD42898 | 2.59 | 281.3 | C14H13ON6 | CCc1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42899 | 0.63 | 143.17 | C4H5ON3S | NC(=O)Nc1nccs1 |
|
AD42900 | 2.27 | 335.37 | C16H11ON6S | N=c1nc2c(c(N)n1C(=O)c1cccc(-c3ccsc3)c1)N=C[N]2 |