| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | FYC8314117 |
| EPA CompTox | DTXSID8048810 |
Structure
| InChI Key | LIXBJWRFCNRAPA-NSHDSACASA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H18Cl1N1O2 |
| Molecular Weight | 243.1 |
| AlogP | 2.47 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 52.49 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 134865-33-1 |
| NORMAN SUSDAT | |
| FDA SRS | FYC8314117 |
CONTENTS
