methyclothiazide   Click here for help

GtoPdb Ligand ID: 7235

Synonyms: Aquatensen® | Enduron®
Approved drug
methyclothiazide is an approved drug (FDA (1960))
Compound class: Synthetic organic
Comment: Methyclothiazide is a diuretic.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 126.33
Molecular weight 358.96
XLogP 0.57
No. Lipinski's rules broken 0
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Canonical SMILES ClCC1Nc2cc(Cl)c(cc2S(=O)(=O)N1C)S(=O)(=O)N
Isomeric SMILES ClCC1Nc2cc(Cl)c(cc2S(=O)(=O)N1C)S(=O)(=O)N
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)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1960))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1050 methyclothiazide
Synonyms Click here for help
Aquatensen® | Enduron®
Database Links Click here for help
CAS Registry No. 135-07-9
ChEMBL Ligand CHEMBL1577
DrugBank Ligand DB00232
DrugCentral Ligand 1759
GtoPdb PubChem SID 178103809
PubChem CID 4121
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UniChem Compound Search for chemical match using the InChIKey CESYKOGBSMNBPD-UHFFFAOYSA-N
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Wikipedia Methyclothiazide