| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | P02BX04 |
| UNII | 4784C8E03O |
| EPA CompTox | DTXSID7043952 |
Structure
| InChI Key | NQPDXQQQCQDHHW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H9Cl3N2OS |
| Molecular Weight | 359.67 |
| AlogP | 6.04 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 37.91 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 94759 |
| ChEMBL | CHEMBL1086440 |
| DrugBank | DB12245 |
| DrugCentral | 2734 |
| FDA SRS | 4784C8E03O |
| PubChem | 50248 |
| SureChEMBL | SCHEMBL165712 |
| ZINC | ZINC000001444556 |
CONTENTS
