| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | V7N8G32K46 |
| EPA CompTox | DTXSID30166800 |
| InChI Key | OKHORWCUMZIORR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C20H18Cl1N1O4 |
| Molecular Weight | 371.09 |
| AlogP | 4.02 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 57.53 |
| Heavy Atoms | 26.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1601-18-9 |
| NORMAN SUSDAT | |
| FDA SRS | V7N8G32K46 |
| PubChem | 15339 |
| ChemSpider | 14601.0 |