Base information
| Cat. No. | |
| CAS No. | 5098-11-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H4N4 |
| Molecular Weight | 108.101 |
| Exact Mass | 108.044 |
| XLogP3 | 0.44478 |
| Mr | 27.7071 |
| PSA | 78.49 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 12 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Nc1c(nc[nH]1)C#N |
