Base information
| Cat. No. | |
| CAS No. | 121880-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H25N3O7S |
| Molecular Weight | 427.472 |
| Exact Mass | 427.141 |
| XLogP3 | 1.0261 |
| Mr | 106.153 |
| PSA | 204.35 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 54 |
| Ring number | 1 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)O)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](CC(=O)O)N |
