| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3A0K4YX051 |
| EPA CompTox | DTXSID50195899 |
Structure
| InChI Key | MGCGJBXTNWUHQE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7NO |
| Molecular Weight | 157.05 |
| AlogP | 2.05 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 29.96 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4363-93-3 |
| NORMAN SUSDAT | |
| FDA SRS | 3A0K4YX051 |
| PubChem | 78072 |
CONTENTS
