| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | L4X2CUC34D |
| EPA CompTox | DTXSID80870440 |
Structure
| InChI Key | GFNKTLQTQSALEJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H5N2O3 |
| Molecular Weight | 164.02 |
| AlogP | 1.56 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 72.57 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 100-28-7 |
| NORMAN SUSDAT | |
| FDA SRS | L4X2CUC34D |
| PubChem | 66012 |
CONTENTS
