| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 838637SD48 |
| EPA CompTox | DTXSID6042078 |
Structure
| InChI Key | RKLCNSACPVMCDV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H15Cl1N2O1 |
| Molecular Weight | 262.09 |
| AlogP | 3.02 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 46.01 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 55283-69-7 |
| NORMAN SUSDAT | |
| FDA SRS | 838637SD48 |
CONTENTS
