Base information
| Cat. No. | |
| CAS No. | 60603-13-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H16N2O5S |
| Molecular Weight | 312.342 |
| Exact Mass | 312.078 |
| XLogP3 | 1.4959 |
| Mr | 78.5002 |
| PSA | 141.03 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 37 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Nc1ccc(c(c1)SC[C@@H](C(=O)O)NC(=O)C)O |
