CFAM Mol ID	CFAMM00006293
Family	CFFAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate family
Superfamily	CFSAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate Superfamily
Class	CFCAD23 Class 23
External ID	CHEMBL2377385	External Source	CHEMBL
PubChem CID	197841	Functional Category	Bioactive
Molecule Name	Lunal
IUPAC Name	2-(2,2-diphenylacetyl)oxyethyl-diethyl-methylazanium;bromide
Synonyms	Remitan;Adiphenine methyl bromide;Diphenylacetic acid 2-(diethylamino)ethyl ester methyl bromide;2-Diethylaminoethyl diphenylacetate methyl bromide;EINECS 228-077-8;NSC 83044;6113-04-8;(2-(Diphenylacetoxy)ethyl)diethylmethylammonium bromide;Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, diphenylacetate;Acetic acid, diphenyl-, ester with diethyl(2-hydroxyethyl)methylammonium bromide
InChi	InChI=1S/C21H28NO2.BrH/c1-4-22(3,5-2)16-17-24-21(23)20(18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,20H,4-5,16-17H2,1-3H3;1H/q+1;/p-1
InChiKey	WMUOPJLADBOCIX-UHFFFAOYSA-M
Formula	C21H28BrNO2	Molecular Weight	406.36
Cross Link	CHEMBL2377385
Structure

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

Last update by

2014.08.29

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

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