| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | J6AJ22VUT4 |
| EPA CompTox | DTXSID40166755 |
Structure
| InChI Key | PATGXOSMIGXGKT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H16N2 |
| Molecular Weight | 152.13 |
| AlogP | 2.09 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 24.72 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15986-96-6 |
| NORMAN SUSDAT | |
| FDA SRS | J6AJ22VUT4 |
| PubChem | 85227 |
| ChemSpider | 76860.0 |
CONTENTS
