Base information
| Cat. No. | |
| CAS No. | 131896-42-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H8N2O2S |
| Molecular Weight | 172.205 |
| Exact Mass | 172.031 |
| XLogP3 | 0.7978 |
| Mr | 41.1732 |
| PSA | 104.45 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N[C@@H](C(=O)O)Cc1cscn1 |
