Base information
| Cat. No. | |
| CAS No. | 400827-72-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C3H5N4NaOS |
| Molecular Weight | 168.153 |
| Exact Mass | 168.008 |
| XLogP3 | -1.4288 |
| Mr | 30.6788 |
| PSA | 63.83 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCCn1nnnc1[S-].[Na+] |
