aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00071 | 1.08 | 194.24 | C7H8N5S | CCSc1nc(N)c2c(n1)[N]C=N2 |
|
AD00072 | 1.2 | 338.9 | C4H7O9P3Cl2 | COP(=O)(O)OP(=O)(O)C(Cl)(Cl)P(=O)(O)O |
|
AD00073 | 1.5 | 290.26 | C15H8O2N5 | CN1C(=O)c2c3c(c4nccn4c2C1=O)[N]c1ncccc1-3 |
|
AD00074 | -3.99 | 307.35 | C12H25O6N3 | NCCC(O)C(=O)NC1CC(N)C(O)C(O)C1OCCO |
|
AD00075 | 3.2 | 271.25 | C15H11O5 | Oc1ccc(-c2[o+]c3cc(O)cc(O)c3cc2O)cc1 |
|
AD00076 | 5.29 | 472.71 | C30H48O4 | CC(CCC(O)C(C)(C)O)C1CCC2(C)C3C(O)CC4C(C)(C)C=CC(=O)C45CC35CCC12C |
|
AD00077 | -3.87 | 309.27 | C11H19O9N | CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO |
|
AD00078 | 1.94 | 171.2 | C11H9ON | NC(=O)c1ccc2ccccc2c1 |
|
AD00079 | -0.27 | 112.02 | CH5O4P | COP(=O)(O)O |
|
AD00080 | -0.33 | 150.12 | C5H4ON5 | Nc1nc(O)c2c(n1)[N]C=N2 |