| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1LR2578324 |
| EPA CompTox | DTXSID9020245 |
Structure
| InChI Key | AVKHCKXGKPAGEI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N3O1 |
| Molecular Weight | 151.07 |
| AlogP | 1.1 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 68.14 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 103-03-7 |
| NORMAN SUSDAT | |
| FDA SRS | 1LR2578324 |
| PubChem | 61002 |
| ChemSpider | 54963.0 |
CONTENTS
