Base information
| Cat. No. | |
| CAS No. | 111846-40-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H67N11O7S2 |
| Molecular Weight | 830.117 |
| Exact Mass | 829.467 |
| XLogP3 | 3.5795 |
| Mr | 224.968 |
| PSA | 347.42 |
| Sequence | - |
| Atom number | 123 |
| Bond number | 123 |
| Ring number | 1 |
| Rotor number | 33 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)CCCNC(=N)N)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)C)CCSC |