Base information
| Cat. No. | |
| CAS No. | 5055-39-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.187 |
| Exact Mass | 175.075 |
| XLogP3 | 1.8626 |
| Mr | 49.1953 |
| PSA | 70.91 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)c1cc2c([nH]1)cccc2 |
