| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | C03AA03 |
| UNII | 0J48LPH2TH |
| EPA CompTox | DTXSID2020713 |
| InChI Key | JZUFKLXOESDKRF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H8ClN3O4S2 |
| Molecular Weight | 297.75 |
| AlogP | -0.35 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 118.36 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 17.0 |
| Mechanism of Action | Action | Reference |
|---|---|---|
| Thiazide-sensitive sodium-chloride cotransporter inhibitor | INHIBITOR | DOI Wikipedia Wikipedia FDA |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Lyase
|
- | - | - | 290-394 | - | |
|
Enzyme
|
- | - | - | 290-394 | - | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 68.94-82.24 | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC22 family of organic cation and anion transporters
|
- | - | - | - |
| Resources | Reference |
|---|---|
| ChEBI | 5778 |
| ChEMBL | CHEMBL435 |
| DrugBank | DB00999 |
| DrugCentral | 1385 |
| FDA SRS | 0J48LPH2TH |
| Human Metabolome Database | HMDB0001928 |
| Guide to Pharmacology | 4836 |
| KEGG | C07041 |
| PDB | HCZ |
| PharmGKB | PA449899 |
| PubChem | 3639 |
| SureChEMBL | SCHEMBL9349 |
| ZINC | ZINC000000896569 |