Base information
| Cat. No. | |
| CAS No. | 565450-82-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H17N5O4 |
| Molecular Weight | 319.316 |
| Exact Mass | 319.128 |
| XLogP3 | -1.4928 |
| Mr | 80.2904 |
| PSA | 116.76 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@]1(O)C#C)O)n1cnc2c1ncnc2N(C)C |
