Base information
| Cat. No. | |
| CAS No. | 81645-08-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14N4O7 |
| Molecular Weight | 326.262 |
| Exact Mass | 326.086 |
| XLogP3 | -1.8023 |
| Mr | 74.6638 |
| PSA | 183.92 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 39 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(c2c1[nH]c(N)nc2=O)C(=O)O |
