| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8028422 |
Structure
| InChI Key | QNXKSVYXNGTPLX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C16H31N1O1 |
| Molecular Weight | 253.24 |
| AlogP | 5.23 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 14.0 |
| Polar Surface Area | 33.02 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68239-19-0 |
| NORMAN SUSDAT | |
| PubChem | 109894 |
| ChemSpider | 98725.0 |
CONTENTS
