| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A5Z5FV3HFS |
| EPA CompTox | DTXSID80196071 |
Structure
| InChI Key | PKRWWZCDLJSJIF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5N1O2 |
| Molecular Weight | 147.03 |
| AlogP | 1.29 |
| Hydrogen Bond Acceptor | 3.0 |
| Polar Surface Area | 42.25 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4421-09-4 |
| NORMAN SUSDAT | |
| FDA SRS | A5Z5FV3HFS |
| PubChem | 78136 |
| ChemSpider | 67593.0 |
CONTENTS
