| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U4F247KXW3 |
| EPA CompTox | DTXSID60228203 |
Structure
| InChI Key | DHGMDHQNUNRMIN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13N1O1 |
| Molecular Weight | 175.1 |
| AlogP | 1.46 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 775-16-6 |
| NORMAN SUSDAT | |
| FDA SRS | U4F247KXW3 |
| PubChem | 69890 |
| ChemSpider | 63085.0 |
CONTENTS
