Trade Names: | |
Synonyms: | |
Status: | Approved (1959) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
ATC: | C03AA01 |
UNII: | 5Q52X6ICJI |
InChI Key | HDWIHXWEUNVBIY-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C15H14F3N3O4S2 |
Molecular Weight | 421.42 |
AlogP | 1.63 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 3.0 |
Polar Surface Area | 118.36 |
Molecular species | NEUTRAL |
Aromatic Rings | 2.0 |
Heavy Atoms | 27.0 |
Action | Mechanism of Action | Reference |
---|---|---|
INHIBITOR | Thiazide-sensitive sodium-chloride cotransporter inhibitor | DOI |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Transporter
Primary active transporter
ATP-binding cassette
ABCB subfamily
|
- | 69550 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Hypertension | 4 | D006973 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 73-48-3 |
ChEBI | 3013 |
ChEMBL | CHEMBL1684 |
DrugBank | DB00436 |
DrugCentral | 305 |
EPA CompTox | DTXSID5022647 |
FDA SRS | 5Q52X6ICJI |
Human Metabolome Database | HMDB0014580 |
Guide to Pharmacology | 7122 |
KEGG | C07758 |
PharmGKB | PA448563 |
PubChem | 2315 |
SureChEMBL | SCHEMBL26016 |