EcoDrugPlus


Trade Names	AQUATENSEN ENDURON METHYCLOTHIAZIDE
Synonyms	Aquatensen Enduron Methyclothiazide NSC-110431
Status
Molecule Category	Free-form
ATC	C03AA08
UNII	R6KDH2S0SX
EPA CompTox	DTXSID6023313


InChI Key	CESYKOGBSMNBPD-UHFFFAOYSA-N
Smiles	CN1C(CCl)Nc2cc(Cl)c(S(N)(=O)=O)cc2S1(=O)=O
InChI	InChI=1S/C9H11Cl2N3O4S2/c1-14-9(4-10)13-6-2-5(11)7(19(12,15)16)3-8(6)20(14,17)18/h2-3,9,13H,4H2,1H3,(H2,12,15,16)

Property Name	Value
Molecular Formula	C9H11Cl2N3O4S2
Molecular Weight	360.24
AlogP	0.6
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	2.0
Polar Surface Area	109.57
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	20.0

Mechanism of Action	Action	Reference
Thiazide-sensitive sodium-chloride cotransporter inhibitor	INHIBITOR	DOI DailyMed

Resources	Reference
ChEBI	6847
ChEMBL	CHEMBL1577
DrugBank	DB00232
DrugCentral	1759
FDA SRS	R6KDH2S0SX
Human Metabolome Database	HMDB0014377
Guide to Pharmacology	7235
KEGG	C07765
PharmGKB	PA164748094
PubChem	4121
SureChEMBL	SCHEMBL49396

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

METHYCLOTHIAZIDE

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Physicochemical Descriptors

Pharmacology

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