| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60186475 |
Structure
| InChI Key | UMCLCZMPTREESK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11N1O3 |
| Molecular Weight | 157.07 |
| AlogP | 0.48 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 59.32 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 32804-77-6 |
| NORMAN SUSDAT | |
| PubChem | 122967 |
| ChemSpider | 109607.0 |
CONTENTS
