Base information
| Cat. No. | |
| CAS No. | 1405-89-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C66H101N17O16SZn |
| Molecular Weight | 1486.06 |
| Exact Mass | 1483.66 |
| XLogP3 | 1.0522 |
| Mr | 396.012 |
| PSA | 561.83 |
| Sequence | - |
| Atom number | 202 |
| Bond number | 204 |
| Ring number | 4 |
| Rotor number | 35 |
| Residues number | 0 |
| Canonical smiles | NCCC[C@H]1NC(=O)C(CCCCNC(=O)C(CC(=O)N)NC(=O)[C@H](NC(=O)C(NC(=O)[C@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)Cc1ccccc1)Cc1[nH]cnc1)CC(=O)[O-])NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C1CSC(=N1)C(C(CC)C)N)CC(C)C)CCC(=O)[O-].[Zn+2] |
