ACETIC ACID

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Search structure


Synonyms	Acetasol Acetic Acetic Acid Acetic Acid, Glacial Acetic acid Acetic acid glacial Acetic acid, diluted Acetic acid, glacial Acetic acid,glacial Aceticum acidum Acetopyrine Aci-jel Acidum aceticum Acidum aceticum glaciale Acopyrine
Status
Molecule Category	Free-form
ATC	G01AD02 S02AA10
UNII	Q40Q9N063P
EPA CompTox	DTXSID5024394

Structure


InChI Key	QTBSBXVTEAMEQO-UHFFFAOYSA-N
Smiles	CC(=O)O
InChI	InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C2H4O2
Molecular Weight	60.05
AlogP	0.09
Hydrogen Bond Acceptor	1.0
Hydrogen Bond Donor	1.0
Polar Surface Area	37.3
Molecular species	ACID
Aromatic Rings	0.0
Heavy Atoms	4.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Src family	-	-	640-900	-	-

Cross References

Resources	Reference
ChEBI	15366
ChEMBL	CHEMBL539
DrugBank	DB03166
DrugCentral	4211
FDA SRS	Q40Q9N063P
Human Metabolome Database	HMDB0000042
Guide to Pharmacology	1058
KEGG	C00033
PDB	ACY
PharmGKB	PA448021
PubChem	176
SureChEMBL	SCHEMBL469
ZINC	ZINC000005224164

CONTENTS

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025