Base information
| Cat. No. | |
| CAS No. | 173731-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11N3O3 |
| Molecular Weight | 209.202 |
| Exact Mass | 209.08 |
| XLogP3 | 1.5718 |
| Mr | 55.4971 |
| PSA | 108.43 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1C(=O)O)NC(=N)N |
