Base information
| Cat. No. | |
| CAS No. | 1538-09-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H56N6O8S2 |
| Molecular Weight | 909.124 |
| Exact Mass | 908.36 |
| XLogP3 | 5.727 |
| Mr | 255.632 |
| PSA | 248.08 |
| Sequence | - |
| Atom number | 120 |
| Bond number | 125 |
| Ring number | 8 |
| Rotor number | 17 |
| Residues number | 0 |
| Canonical smiles | N(Cc1ccccc1)CCNCc1ccccc1.O=C(Cc1ccccc1)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C.O=C(Cc1ccccc1)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C |
