Base information
| Cat. No. | |
| CAS No. | 857410-67-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11N3O2 |
| Molecular Weight | 181.192 |
| Exact Mass | 181.085 |
| XLogP3 | 1.1251 |
| Mr | 47.4889 |
| PSA | 78.1 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cc(C)nc(n1)N |
