CFam Chemical Families Database
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You are searching for "CFAMM00146830" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00146830
Family CFFCD257 Muscarinic acetylcholine receptor M1 Ligand GSK1034702 Family
Superfamily CFSCD235 Muscarinic acetylcholine receptor M1 Ligand GSK1034702 Superfamily
Class CFCAD614 Class 614
External ID 18731011 External Source PubChem
PubChem CID 18731011 Functional Category Patent Compound
Molecule Name AGN-PC-020J8T
IUPAC Name methyl 2-[4-[4-(4-hydroxyphenyl)hexan-2-yl]phenoxy]acetate
Synonyms methyl 2-[4-[4-(4-hydroxyphenyl)hexan-2-yl]phenoxy]acetate
InChi InChI=1S/C21H26O4/c1-4-16(18-5-9-19(22)10-6-18)13-15(2)17-7-11-20(12-8-17)25-14-21(23)24-3/h5-12,15-16,22H,4,13-14H2,1-3H3
InChiKey GBKGXPUNWABJSZ-UHFFFAOYSA-N
Formula C21H26O4 Molecular Weight 342.43
Cross Link
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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