Base information
| Cat. No. | |
| CAS No. | 251293-28-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C64H85N13O18S2 |
| Molecular Weight | 1388.57 |
| Exact Mass | 1387.56 |
| XLogP3 | 3.1139 |
| Mr | 377.41 |
| PSA | 553 |
| Sequence | - |
| Atom number | 182 |
| Bond number | 187 |
| Ring number | 6 |
| Rotor number | 32 |
| Residues number | 0 |
| Canonical smiles | NCCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)Cc1ccc(cc1)O)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)N)CC(=O)O)Cc1c[nH]c2c1cccc2 |
