Base information
| Cat. No. | |
| CAS No. | 25477-96-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11N5O2 |
| Molecular Weight | 221.216 |
| Exact Mass | 221.091 |
| XLogP3 | 0.5528 |
| Mr | 56.6954 |
| PSA | 95.92 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)Cn1cnc2c1ncnc2N |