HuagongsheHuagongshe Chemistry Print Report · For research reference only
Droxinavir
Identifiers & Physical Properties
| CAS No. | 159910-86-8 |
|---|---|
| Molecular formula | C29H51N5O4 |
| Average molar mass | 533.7 g/mol |
| Monoisotopic mass | 533.39410513 g/mol |
| SMILES | CNCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(CCC(C)C)C(=O)NC(C)(C)C)C(C)(C)C |
| InChIKey | ICOKEKQSBZSLIB-JBRSBNLGSA-N |
| PubChem CID | 465403 |
| ChEMBL | CHEMBL3990346 |
Chemical & Physical Properties
| XLogP | 3.7 |
|---|---|
| Topological polar surface area | 123 |
| Hydrogen bond donors | 5 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 15 |
| Heavy atoms | 38 |
| Formal charge | 0 |
| Complexity | 738 |