Base information
| Cat. No. | |
| CAS No. | 172546-75-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C46H55N11O7S |
| Molecular Weight | 906.063 |
| Exact Mass | 905.401 |
| XLogP3 | 4.8927 |
| Mr | 246.992 |
| PSA | 333.9 |
| Sequence | - |
| Atom number | 120 |
| Bond number | 125 |
| Ring number | 6 |
| Rotor number | 29 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)N)CS |
