Base information
| Cat. No. | |
| CAS No. | 1192364-56-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H52N6O7S2 |
| Molecular Weight | 684.911 |
| Exact Mass | 684.334 |
| XLogP3 | 2.664 |
| Mr | 197.171 |
| PSA | 217.45 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 99 |
| Ring number | 2 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | C[C@H]1CN([C@@H](C)CN([C@H](CN([C@H](CN1[C@H](C(=O)NCCSSc1ccccn1)C)C)[C@@H](C(=O)O)C)C)C(C(=O)O)C)[C@@H](C(=O)O)C |
