acetoxolone 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definition	Drug id	CAS RN
steroids not used as glucocorticosteroids	62	6277-14-1

Description:

Molecule

Description

Molfile Inchi Smiles

Synonyms:

acetoxolone
acetylglycyrrhetic acid
acetylglycyrrhetinic acid
glycyrrhetic acid acetate
glycyrrhetinic acid acetate
glycyrrhetinyl acetate

Molecular weight: 512.73
Formula: C32H48O5
CLOGP: 7.42
LIPINSKI: 2
HAC: 5
HDO: 1
TPSA: 80.67
ALOGS: -5.97
ROTB: 3

Drug dosage:

None

ADMET properties:

None

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:

Source	Code	Description
ATC	A02BX09	ALIMENTARY TRACT AND METABOLISM DRUGS FOR ACID RELATED DISORDERS DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD) Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)

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

Disease	Relation	SNOMED_ID	DOID
Gastritis	indication	4556007	DOID:4029

🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation level	Dissociation constant	Type (acidic/basic)
pKa1	4.89	acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

Target	Class	Pharos	UniProt	Action	Type	Activity value (-log[M])	Mechanism action	Bioact source	MoA source
Liver carboxylesterase 1	Enzyme	P23141	EST1_HUMAN		IC50	4.30		CHEMBL
Estradiol 17-beta-dehydrogenase 1	Enzyme	P14061	DHB1_HUMAN		IC50	4.73		CHEMBL
Estradiol 17-beta-dehydrogenase 2	Enzyme	P37059	DHB2_HUMAN		IC50	5.42		CHEMBL
Corticosteroid 11-beta-dehydrogenase isozyme 2	Enzyme	P80365	DHI2_HUMAN		IC50	6.70		CHEMBL
Corticosteroid 11-beta-dehydrogenase isozyme 1	Enzyme	P28845	DHI1_HUMAN		IC50	6.10		CHEMBL
Cocaine esterase	Enzyme	O00748	EST2_HUMAN		IC50	4.39		CHEMBL

External reference:

ID	Source
16784	RXNORM
C0050521	UMLSCUI
CHEBI:81306	CHEBI
CHEMBL207413	ChEMBL_ID
DB13640	DRUGBANK_ID
C013384	MESH_SUPPLEMENTAL_RECORD_UI
CWW961Q19K	UNII
94320	PUBCHEM_CID
004300	NDDF

Pharmaceutical products:

None