EcoDrugPlus


Synonyms	Apo-benzydamine Benzindamine Benzydamine
Status
Molecule Category	Free-form
ATC	A01AD02 G02CC03 M01AX07 M02AA05 R02AX03
UNII	4O21U048EF
EPA CompTox	DTXSID7047859

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SubStructure

Threshold (%) >= 70


InChI Key	CNBGNNVCVSKAQZ-UHFFFAOYSA-N
Smiles	CN(C)CCCOc1nn(Cc2ccccc2)c2ccccc12
InChI	InChI=1S/C19H23N3O/c1-21(2)13-8-14-23-19-17-11-6-7-12-18(17)22(20-19)15-16-9-4-3-5-10-16/h3-7,9-12H,8,13-15H2,1-2H3

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C19H23N3O
Molecular Weight	309.41
AlogP	3.42
Hydrogen Bond Acceptor	4.0
Number of Rotational Bond	7.0
Polar Surface Area	30.29
Molecular species	BASE
Aromatic Rings	3.0
Heavy Atoms	23.0

Mechanism of Action	Action	Reference
Cyclooxygenase inhibitor	INHIBITOR	PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed

Target Conservation


Protein: Cyclooxygenase Description: Prostaglandin G/H synthase 1 Organism : Homo sapiens P23219 ENSG00000095303












Protein: Cyclooxygenase Description: Prostaglandin G/H synthase 2 Organism : Homo sapiens P35354 ENSG00000073756

Cross References

Resources	Reference
ChEBI	94563
ChEMBL	CHEMBL12610
DrugBank	DB09084
DrugCentral	3881
FDA SRS	4O21U048EF
PubChem	12555
SureChEMBL	SCHEMBL26172
ZINC	ZINC000002020083

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

BENZYDAMINE

Structure

Physicochemical Descriptors

Pharmacology

Target Conservation

Related Entries

Cross References