benzthiazide indications/contra

Stem definitionDrug idCAS RN
diuretics, chlorothiazide derivatives 332 91-33-8

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • benzthiazide
  • benzothiazide
  • dihydrex
  • lemazide
  • Molecular weight: 431.92
  • Formula: C15H14ClN3O4S3
  • CLOGP: 2.17
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 2
  • TPSA: 118.69
  • ALOGS: -4.55
  • ROTB: 5

Drug dosage:

None

Approvals:

DateAgencyCompanyOrphan
Oct. 14, 1960 FDA AH ROBINS INC

FDA Adverse Event Reporting System

None

Pharmacologic Action:

scroll-->
SourceCodeDescription
CHEBI has role CHEBI:35498 diuretic
CHEBI has role CHEBI:35674 antihypertensive agent

Drug Use (View source of the data)

scroll-->
DiseaseRelationSNOMED_IDDOID
Suicidal thoughts contraindication 6471006
Peptic ulcer contraindication 13200003 DOID:750
Chronic disease of respiratory system contraindication 17097001
Electroconvulsive therapy contraindication 23835007
Depressive disorder contraindication 35489007 DOID:2848
Conduction disorder of the heart contraindication 44808001
Chronic heart failure contraindication 48447003
Ulcerative colitis contraindication 64766004 DOID:8577
Epilepsy contraindication 84757009 DOID:1826
Kidney disease contraindication 90708001 DOID:2527
Calculus in biliary tract contraindication 266474003

Acid dissociation constants calculated using MoKa v3.0.0

scroll-->
Dissociation levelDissociation constantType (acidic/basic)
pKa1 6.99 acidic
pKa2 10.02 acidic
pKa3 5.33 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

scroll-->
TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Solute carrier family 12 member 3 Transporter INHIBITOR A2 8.17 WOMBAT-PK CHEMBL
Calcium-activated potassium channel subunit alpha-1 Ion channel WOMBAT-PK
Carbonic anhydrase 4 Enzyme WOMBAT-PK
Carbonic anhydrase 1 Enzyme WOMBAT-PK
Carbonic anhydrase 2 Enzyme WOMBAT-PK

External reference:

scroll-->
IDSource
DB00562 DRUGBANK_ID
4018417 VUID
N0000179049 NUI
C0053245 UMLSCUI
7125 IUPHAR_LIGAND_ID
D00651 KEGG_DRUG
1TD8J48L61 UNII
944 INN_ID
4018417 VANDF
N0000179049 NDFRT
N0000146743 NDFRT
19008 RXNORM
400874008 SNOMEDCT_US
66290002 SNOMEDCT_US
d00644 MMSL
4263 MMSL
002298 NDDF
2343 PUBCHEM_CID
CHEMBL1201039 ChEMBL_ID
C004463 MESH_SUPPLEMENTAL_RECORD_UI
CHEBI:3047 CHEBI

Pharmaceutical products:

None