EcoDrugPlus


Keyword(s):	Human Metabolites
Molecule Category	Salt-form
UNII	7GVF119EM8
EPA CompTox	DTXSID20998132

Keyword(s):

Human Metabolites

Molecule Category

Salt-form

UNII

7GVF119EM8

EPA CompTox

DTXSID20998132


InChI Key	CWPAAKNARYMZLM-UHFFFAOYSA-L
Smiles	[I-].[I-].C[N+](C)(C)C1CCC(CC1)CC2CCC(CC2)[N+](C)(C)C
InChI	InChI=1/C19H40N2.2HI/c1-20(2,3)18-11-7-16(8-12-18)15-17-9-13-19(14-10-17)21(4,5)6;;/h16-19H,7-15H2,1-6H3;2*1H/q+2;;/p-2

InChI Key

CWPAAKNARYMZLM-UHFFFAOYSA-L

Smiles

[I-].[I-].C[N+](C)(C)C1CCC(CC1)CC2CCC(CC2)[N+](C)(C)C

InChI

InChI=1/C19H40N2.2HI/c1-20(2,3)18-11-7-16(8-12-18)15-17-9-13-19(14-10-17)21(4,5)6;;/h16-19H,7-15H2,1-6H3;2*1H/q+2;;/p-2

Property Name	Value
Molecular Formula	C19H40N2
Molecular Weight	550.13
AlogP	-2.09
Number of Rotational Bond	4.0
Heavy Atoms	23.0

Property Name

Value

Molecular Formula

C19H40N2

Molecular Weight

550.13

AlogP

-2.09

Number of Rotational Bond

4.0

Heavy Atoms

23.0

Resources	Reference
CAS NUMBER	7681-78-9
NORMAN SUSDAT
FDA SRS	7GVF119EM8
PubChem	71849

Resources

Reference

CAS NUMBER

7681-78-9

NORMAN SUSDAT

FDA SRS

7GVF119EM8

PubChem

71849

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, Volume 54, Issue D1, 6 January 2026, Pages D1397–D1404, https://doi.org/10.1093/nar/gkaf1251

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

Last update: Monday, 3 November 2025

MEBEZONIUM IODIDE

Structure

Physicochemical Descriptors

Cross References