CFam Chemical Families Database
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You are searching for "CFAMM00023228" in compound.

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CFAM Mol ID CFAMM00023228
Family CFFAD129 Acetylcholinesterase Inhibitor Rivastigmine Family
Superfamily CFSAD121 Acetylcholinesterase Inhibitor Rivastigmine Superfamily
Class CFCAD120 Class 120
External ID CHEMBL347503 External Source CHEMBL
PubChem CID 11808166 Functional Category Bioactive
Molecule Name Phenethylamine deriv. 50a
IUPAC Name [3-[2-(prop-2-ynylamino)ethyl]phenyl] N,N-dimethylcarbamate
Synonyms AGN-PC-00GL45;[3-[2-(prop-2-ynylamino)ethyl]phenyl] N,N-dimethylcarbamate
InChi InChI=1S/C14H18N2O2/c1-4-9-15-10-8-12-6-5-7-13(11-12)18-14(17)16(2)3/h1,5-7,11,15H,8-10H2,2-3H3
InChiKey HYXHQZASJISSQN-UHFFFAOYSA-N
Formula C14H18N2O2 Molecular Weight 246.30
Cross Link CHEMBL347503
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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