Base information
| Cat. No. | |
| CAS No. | 391953-90-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N3O |
| Molecular Weight | 179.219 |
| Exact Mass | 179.106 |
| XLogP3 | 0.0953 |
| Mr | 53.9724 |
| PSA | 57.78 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1nc2CCNCCc2c(=O)[nH]1 |