| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80217230 |
Structure
| InChI Key | FNDBKEJKVBORFC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H41N3 |
| Molecular Weight | 299.33 |
| AlogP | 3.83 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 18.0 |
| Polar Surface Area | 50.08 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 67022-37-1 |
| NORMAN SUSDAT | |
| PubChem | 181864 |
| ChemSpider | 158184.0 |
CONTENTS
