Base information
| Cat. No. | |
| CAS No. | 105931-59-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H30IN3O5S |
| Molecular Weight | 563.449 |
| Exact Mass | 563.095 |
| XLogP3 | 3.6103 |
| Mr | 130.18 |
| PSA | 149.9 |
| Sequence | - |
| Atom number | 61 |
| Bond number | 61 |
| Ring number | 1 |
| Rotor number | 16 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)I)CC(C)C)NC=O |
