benzthiazide   Click here for help

GtoPdb Ligand ID: 7125

Synonyms: Aquatag® | Fovane®
Approved drug
benzthiazide is an approved drug (FDA (1960))
Compound class: Synthetic organic
Comment: Benzthiazide is a thiazide diuretic. It is no longer available in the US or UK, but marketing may be authorised by other national approval agencies.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 160.75
Molecular weight 430.98
XLogP 1.69
No. Lipinski's rules broken 0
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Canonical SMILES Clc1cc2N=C(CSCc3ccccc3)NS(=O)(=O)c2cc1S(=O)(=O)N
Isomeric SMILES Clc1cc2N=C(CSCc3ccccc3)NS(=O)(=O)c2cc1S(=O)(=O)N
InChI InChI=1S/C15H14ClN3O4S3/c16-11-6-12-14(7-13(11)25(17,20)21)26(22,23)19-15(18-12)9-24-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,18,19)(H2,17,20,21)
No information available.
Summary of Clinical Use Click here for help
Used to treat hypertension and edema.
Mechanism Of Action and Pharmacodynamic Effects Click here for help
Reduces water retention by inhibiting Na+/Cl- reabsorption from the distal convoluted tubules in the kidneys by inhibiting the Na-Cl symporter SLC12A3.