Base information
| Cat. No. | |
| CAS No. | 21438-63-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H21N3O3S |
| Molecular Weight | 335.421 |
| Exact Mass | 335.13 |
| XLogP3 | 2.4514 |
| Mr | 91.9856 |
| PSA | 133.51 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 45 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)N |
