| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7C34Z22DNT |
| EPA CompTox | DTXSID10189815 |
Structure
| InChI Key | GNBSIDZPFKKPIP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H14N2 |
| Molecular Weight | 222.12 |
| AlogP | 3.22 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 27.03 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 36271-19-9 |
| NORMAN SUSDAT | |
| FDA SRS | 7C34Z22DNT |
| PubChem | 118937 |
| ChemSpider | 106281.0 |
CONTENTS
