Base information
| Cat. No. | |
| CAS No. | 851776-28-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8N6 |
| Molecular Weight | 176.179 |
| Exact Mass | 176.081 |
| XLogP3 | 0.0785 |
| Mr | 44.3844 |
| PSA | 83.14 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 23 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | n1[nH]nc(n1)c1n[nH]c2c1CCC2 |
