Base information
| Cat. No. | |
| CAS No. | 116599-55-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9N3 |
| Molecular Weight | 147.177 |
| Exact Mass | 147.08 |
| XLogP3 | 1.5747 |
| Mr | 43.8207 |
| PSA | 41.57 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1cc(C)nc2c1nc[nH]2 |
