| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID7071733 |
| InChI Key | OWXIREOFSQQJKK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C27H28N4S4 |
| Molecular Weight | 536.12 |
| AlogP | 8.02 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 76.1 |
| Heavy Atoms | 35.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68758-72-5 |
| NORMAN SUSDAT | |
| PubChem | 111566 |
| ChemSpider | 100092.0 |