Trade Names: | |
Synonyms: | |
Status: | Approved (1983) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
ATC: | C03CA02 |
UNII: | 0Y2S3XUQ5H |
InChI Key | MAEIEVLCKWDQJH-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C17H20N2O5S |
Molecular Weight | 364.42 |
AlogP | 3.04 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 8.0 |
Polar Surface Area | 118.72 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 25.0 |
Primary Target | |
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Kidney-specific Na-K-Cl symporter |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 72 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Heart Failure | 4 | D006333 | FDA |
Heart Failure | 4 | D006333 | ClinicalTrials |
Autistic Disorder | 3 | D001321 | ClinicalTrials |
Child Development Disorders, Pervasive | 2 | D002659 | ClinicalTrials |
Hypokalemic Periodic Paralysis | 2 | D020514 | ClinicalTrials |
Renal Insufficiency, Chronic | 2 | D051436 | ClinicalTrials |
Carcinoma, Hepatocellular | 1 | D006528 | ClinicalTrials |
Diabetes Mellitus, Type 2 | 1 | D003924 | ClinicalTrials |
Seizures | 1 | D012640 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 28395-03-1 |
ChEBI | 3213 |
ChEMBL | CHEMBL1072 |
DrugBank | DB00887 |
DrugCentral | 427 |
EPA CompTox | DTXSID5022699 |
FDA SRS | 0Y2S3XUQ5H |
Human Metabolome Database | HMDB0015024 |
Guide to Pharmacology | 4837 |
KEGG | D00247 |
PharmGKB | PA448682 |
PubChem | 2471 |
SureChEMBL | SCHEMBL27525 |
ZINC | ZINC000003813061 |