| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SZE5F94WJH |
| EPA CompTox | DTXSID10190244 |
Structure
| InChI Key | MMXYNKLYVRNTCK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H15N1 |
| Molecular Weight | 245.12 |
| AlogP | 4.26 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3678-70-4 |
| NORMAN SUSDAT | |
| FDA SRS | SZE5F94WJH |
| PubChem | 77250 |
| ChemSpider | 69675.0 |
CONTENTS
