EcoDrugPlus


Synonyms	Propoxycaine
Status
Molecule Category	Free-form
UNII	EPD1EH7F53
EPA CompTox	DTXSID6047866


InChI Key	CAJIGINSTLKQMM-UHFFFAOYSA-N
Smiles	CCCOc1cc(N)ccc1C(=O)OCCN(CC)CC
InChI	InChI=1S/C16H26N2O3/c1-4-10-20-15-12-13(17)7-8-14(15)16(19)21-11-9-18(5-2)6-3/h7-8,12H,4-6,9-11,17H2,1-3H3

Property Name	Value
Molecular Formula	C16H26N2O3
Molecular Weight	294.4
AlogP	2.56
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	9.0
Polar Surface Area	64.79
Molecular species	BASE
Aromatic Rings	1.0
Heavy Atoms	21.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Ion channel Voltage-gated ion channel Voltage-gated sodium channel	-	-	-	-	30

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Cavia porcellus	-	-	-	-	30

Resources	Reference
ChEBI	8496
ChEMBL	CHEMBL1195
DrugBank	DB09342
DrugCentral	3496
FDA SRS	EPD1EH7F53
KEGG	C07895
PubChem	6843
SureChEMBL	SCHEMBL83073
ZINC	ZINC000001530942

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

PROPOXYCAINE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Cross References