| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CRA4ZTF26W |
| EPA CompTox | DTXSID90145474 |
Structure
| InChI Key | GRTWYIODJKVPEV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H11N1 |
| Molecular Weight | 169.09 |
| AlogP | 3.06 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10273-89-9 |
| NORMAN SUSDAT | |
| FDA SRS | CRA4ZTF26W |
| PubChem | 82510 |
| ChemSpider | 74463.0 |
CONTENTS
