| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 3H0042311V |
Structure
| InChI Key | XUPZAARQDNSRJB-SJDTYFKWSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C19H22ClNS |
| Molecular Weight | 331.91 |
| AlogP | 4.68 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 3.24 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 21.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 36805 |
| ChEMBL | CHEMBL1711280 |
| EPA CompTox | DTXSID60873550 |
| FDA SRS | 3H0042311V |
| PubChem | 9884029 |
CONTENTS