| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NDD4A44NG2 |
| EPA CompTox | DTXSID70189694 |
Structure
| InChI Key | BDVKAMAALQXGLM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H13N1O1 |
| Molecular Weight | 127.1 |
| AlogP | 0.67 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3612-18-8 |
| NORMAN SUSDAT | |
| FDA SRS | NDD4A44NG2 |
| PubChem | 77159 |
| ChemSpider | 69596.0 |
CONTENTS
