| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A2T929DMG4 |
| EPA CompTox | DTXSID3044627 |
Structure
| InChI Key | ASOKPJOREAFHNY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H5N3O1 |
| Molecular Weight | 135.04 |
| AlogP | 0.67 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 50.94 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2592-95-2 |
| NORMAN SUSDAT | |
| FDA SRS | A2T929DMG4 |
| PubChem | 75771 |
| ChemSpider | 68282.0 |
CONTENTS
