| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZP45BJG86L |
| EPA CompTox | DTXSID60162774 |
Structure
| InChI Key | SIFCHNIAAPMMKG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N1O4 |
| Molecular Weight | 157.04 |
| AlogP | -0.39 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 63.68 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 14464-29-0 |
| NORMAN SUSDAT | |
| FDA SRS | ZP45BJG86L |
| PubChem | 84460 |
| ChemSpider | 76189.0 |
CONTENTS
