Base information
| Cat. No. | |
| CAS No. | 2544-31-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H15NO3S |
| Molecular Weight | 241.307 |
| Exact Mass | 241.077 |
| XLogP3 | 2.0406 |
| Mr | 64.3912 |
| PSA | 97.85 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 31 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)CSC[C@@H](C(=O)O)N |
