Base information
| Cat. No. | |
| CAS No. | 80685-22-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9N5O4 |
| Molecular Weight | 239.188 |
| Exact Mass | 239.065 |
| XLogP3 | -0.6583 |
| Mr | 56.2859 |
| PSA | 136.12 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)COCn1cnc2c1nc(N)[nH]c2=O |
