Base information
| Cat. No. | |
| CAS No. | 64918-77-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8N2O4S |
| Molecular Weight | 216.214 |
| Exact Mass | 216.02 |
| XLogP3 | -0.2788 |
| Mr | 51.714 |
| PSA | 129.16 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1[C@@H](N)[C@@H]2N1C(=C(CS2)O)C(=O)O |
