| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10175718 |
Structure
| InChI Key | OTFFCAGPSWJBDK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7N3 |
| Molecular Weight | 133.06 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 54.7 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 21443-96-9 |
| NORMAN SUSDAT | |
| PubChem | 88901 |
| ChemSpider | 80219.0 |
CONTENTS
