| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C4FV47YR2S |
| EPA CompTox | DTXSID00166973 |
Structure
| InChI Key | UNWMSJSGBWRHNY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H37N1O2 |
| Molecular Weight | 299.28 |
| AlogP | 4.79 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 15.0 |
| Polar Surface Area | 29.54 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16070-12-5 |
| NORMAN SUSDAT | |
| FDA SRS | C4FV47YR2S |
| PubChem | 85269 |
| ChemSpider | 76900.0 |
CONTENTS
