EcoDrugPlus


Synonyms	Algafan D-propoxyphene Depromic Dextropropoxyphen Dextropropoxyphene J5.928E Levopropoxyphene Propoxyphene Propoxyphene, d- SK-65
Status
Molecule Category	Free-form
UNII	S2F83W92TK
EPA CompTox	DTXSID1023524


InChI Key	XLMALTXPSGQGBX-GCJKJVERSA-N
Smiles	CCC(=O)O[C@](Cc1ccccc1)(c1ccccc1)[C@H](C)CN(C)C
InChI	InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3/t18-,22+/m1/s1

Property Name	Value
Molecular Formula	C22H29NO2
Molecular Weight	339.48
AlogP	4.28
Hydrogen Bond Acceptor	3.0
Number of Rotational Bond	8.0
Polar Surface Area	29.54
Molecular species	BASE
Aromatic Rings	2.0
Heavy Atoms	25.0

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Mus musculus	-	-	-	-	50-50
Rattus norvegicus	-	-	-	-	23-56.2

Resources	Reference
ChEBI	51173
ChEMBL	CHEMBL1213351
DrugBank	DB00647
DrugCentral	844
FDA SRS	S2F83W92TK
Guide to Pharmacology	7593
PubChem	10100
SureChEMBL	SCHEMBL25405
ZINC	ZINC000001530769

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

PROPOXYPHENE

Structure

Physicochemical Descriptors

Pharmacology

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