etohexadiol 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
4774 94-96-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • etohexadiol
  • ethohexadiol
  • octylene glycol
insect repellent, moderately irritating to eyes, mucous membranes, but not to skin; RN given refers to cpd without isomeric designation; structure
  • Molecular weight: 146.23
  • Formula: C8H18O2
  • CLOGP: 1.26
  • LIPINSKI: 0
  • HAC: 2
  • HDO: 2
  • TPSA: 40.46
  • ALOGS: -0.48
  • ROTB: 5

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,AXL,BRAF,BTK,CAMK2D,CDK4,CDK5,CDK9,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,ITK,MAP2K6,MAP3K21,MAPK7,NTRK2,PDK2,PDK4,PRKDC,STK33,SYK,TEK,TGFBR1,ZAP70 27
kinase-selectivity-class AXL,CDK4,GRK2,MAP2K6 4
pfas-class PFAS structural alert (1 = True, 0 = False) 0

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
ATC P03BX06 ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
INSECTICIDES AND REPELLENTS
Other insecticides and repellents
CHEBI has role CHEBI:35442 antiparasitic agent

Related Drugs by ATC class:

P03BX Other insecticides and repellents 5 drugs

Drug Use | Suggest Off label Use Form| |View source of the data|

DiseaseRelationSNOMED_IDDOID
Insect repellent indication 75627006




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

None

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
CHEBI:749822 CHEBI
CHEMBL1451179 ChEMBL_ID
DB13826 DRUGBANK_ID
1362891 RXNORM
003002 NDDF
C0059726 UMLSCUI
7211 PUBCHEM_CID
C004917 MESH_SUPPLEMENTAL_RECORD_UI
M9JGK7U88V UNII

Pharmaceutical products:

None