| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A51NP1DL2T |
| EPA CompTox | DTXSID7020978 |
Structure
| InChI Key | RJKGJBPXVHTNJL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7N1O2 |
| Molecular Weight | 173.05 |
| AlogP | 2.75 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.14 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 86-57-7 |
| NORMAN SUSDAT | |
| FDA SRS | A51NP1DL2T |
| PubChem | 6849 |
| ChemSpider | 6588.0 |
CONTENTS
