| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0623J1FR67 |
| EPA CompTox | DTXSID10195759 |
Structure
| InChI Key | SSSZZOVUXFLWCQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H38N2 |
| Molecular Weight | 270.3 |
| AlogP | 4.63 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 16.0 |
| Polar Surface Area | 38.05 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4317-79-7 |
| NORMAN SUSDAT | |
| FDA SRS | 0623J1FR67 |
| PubChem | 78012 |
| ChemSpider | 70394.0 |
CONTENTS
