Base information
| Cat. No. | |
| CAS No. | 13040-58-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7N5O |
| Molecular Weight | 177.163 |
| Exact Mass | 177.065 |
| XLogP3 | 0.1849 |
| Mr | 47.3241 |
| PSA | 97.55 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1cnc2c(n1)nc([nH]c2=O)N |
