| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID5067920 |
| InChI Key | GVSKMWDMUCOLRO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H27Cl2N3O3S1 |
| Molecular Weight | 483.12 |
| AlogP | 4.27 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 62.21 |
| Heavy Atoms | 31.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 35441-18-0 |
| NORMAN SUSDAT | |
| PubChem | 118821 |
| ChemSpider | 106175.0 |