| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID5070105 |
| InChI Key | CRNZYEPBJAYXLA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H21Cl2N5O2S1 |
| Molecular Weight | 453.08 |
| AlogP | 5.4 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 89.13 |
| Heavy Atoms | 29.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 64501-19-5 |
| NORMAN SUSDAT | |
| PubChem | 116632 |
| ChemSpider | 102256.0 |