hexamidine Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
3275 3811-75-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • hexamidine
  • desmodine
  • hexamidine diisethionate
  • hexamidine isethionate
  • hexamidine isetionate
  • hexamidine dihydrochloride
  • hexamidine hydrochloride
  • hexamidine HCl
  • hexomedin
  • Molecular weight: 354.45
  • Formula: C20H26N4O2
  • CLOGP: 2.84
  • LIPINSKI: 0
  • HAC: 6
  • HDO: 4
  • TPSA: 118.20
  • ALOGS: -4.40
  • ROTB: 11

Drug dosage:

None

ADMET properties:

None

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
ATC D08AC04 DERMATOLOGICALS
ANTISEPTICS AND DISINFECTANTS
ANTISEPTICS AND DISINFECTANTS
Biguanides and amidines
ATC R01AX07 RESPIRATORY SYSTEM
NASAL PREPARATIONS
DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
Other nasal preparations
ATC R02AA18 RESPIRATORY SYSTEM
THROAT PREPARATIONS
THROAT PREPARATIONS
Antiseptics
ATC S01AX08 SENSORY ORGANS
OPHTHALMOLOGICALS
ANTIINFECTIVES
Other antiinfectives
ATC S03AA05 SENSORY ORGANS
OPHTHALMOLOGICAL AND OTOLOGICAL PREPARATIONS
ANTIINFECTIVES
Antiinfectives
MeSH PA D000890 Anti-Infective Agents
CHEBI has role CHEBI:33281 antibiotics
CHEBI has role CHEBI:48218 antiseptics

Drug Use (View source of the data)

DiseaseRelationSNOMED_IDDOID
Acanthamoeba keratitis indication 231896005

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 11.38 Basic
pKa2 10.78 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Prothrombin Enzyme Ki 6.65 CHEMBL
Urokinase-type plasminogen activator Enzyme Ki 4.84 CHEMBL
Trypsin-1 Enzyme Ki 5.57 CHEMBL
Suppressor of tumorigenicity 14 protein Enzyme Ki 6.03 CHEMBL

External reference:

IDSource
D07206 KEGG_DRUG
659-40-5 SECONDARY_CAS_RN
C0062648 UMLSCUI
CHEBI:87184 CHEBI
DID PDB_CHEM_ID
CHEMBL25105 ChEMBL_ID
DB03808 DRUGBANK_ID
C018961 MESH_SUPPLEMENTAL_RECORD_UI
1393 INN_ID
3483C2H13H UNII
65130 PUBCHEM_CID
1939371 RXNORM
005603 NDDF
005604 NDDF
703831002 SNOMEDCT_US
703832009 SNOMEDCT_US

Pharmaceutical products:

None