Base information
| Cat. No. | |
| CAS No. | 879-08-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9N5O |
| Molecular Weight | 179.179 |
| Exact Mass | 179.081 |
| XLogP3 | 0.3029 |
| Mr | 48.6221 |
| PSA | 89.59 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CCn1cnc2c1nc(N)[nH]c2=O |
