| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AMG3VF7EBL |
| EPA CompTox | DTXSID80208204 |
Structure
| InChI Key | DCYGAPKNVCQNOE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H16O2 |
| Molecular Weight | 288.12 |
| AlogP | 4.11 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 22.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 595-91-5 |
| NORMAN SUSDAT | |
| FDA SRS | AMG3VF7EBL |
| PubChem | 68992 |
| ChemSpider | 5414371.0 |
CONTENTS
