| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WY440H625W |
| EPA CompTox | DTXSID30145610 |
Structure
| InChI Key | LQJARUQXWJSDFL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14N2O2 |
| Molecular Weight | 194.11 |
| AlogP | 0.98 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 64.35 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 103-97-9 |
| NORMAN SUSDAT | |
| FDA SRS | WY440H625W |
| PubChem | 66901 |
| ChemSpider | 60263.0 |
CONTENTS
