EcoDrugPlus


Synonyms	Anhydrous propyl gallate (e 310) E-310 E310 FEMA NO. 2947 Gallic acid, propyl ester INS NO.310 INS-310 NSC-2626 Propyl gallate Propyl gallate (e 310)
Status
Molecule Category	Free-form
UNII	8D4SNN7V92
EPA CompTox	DTXSID5021201


InChI Key	ZTHYODDOHIVTJV-UHFFFAOYSA-N
Smiles	CCCOC(=O)c1cc(O)c(O)c(O)c1
InChI	InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3

Property Name	Value
Molecular Formula	C10H12O5
Molecular Weight	212.2
AlogP	1.37
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	3.0
Polar Surface Area	86.99
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	15.0

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Bos taurus	-	-	-	-	70
Rattus norvegicus	-	-	-	-	100-100

Resources	Reference
ChEBI	10607
ChEMBL	CHEMBL7983
DrugBank	DB12450
FDA SRS	8D4SNN7V92
Human Metabolome Database	HMDB0033835
KEGG	C11155
PubChem	4947
SureChEMBL	SCHEMBL22630
ZINC	ZINC000001532172

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

PROPYL GALLATE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Cross References