CFam Chemical Families Database
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You are searching for "CFAMM00061098" in compound.

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CFAM Mol ID CFAMM00061098
Family CFFAD432 Beta adrenergic receptor Ligand Dipivefrin Family
Superfamily CFSAD375 Beta adrenergic receptor Ligand Dipivefrin Superfamily
Class CFCAD332 Class 332
External ID 54073054 External Source PubChem
PubChem CID 54073054 Functional Category Patent Compound
Molecule Name AGN-PC-0A2IVG
IUPAC Name 3-[4-[[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]methyl]phenyl]prop-2-enenitrile
Synonyms 3-[4-[[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]methyl]phenyl]prop-2-enenitrile
InChi InChI=1S/C23H28N2O4/c1-27-22-10-9-19(14-23(22)28-2)11-13-25-15-21(26)17-29-16-20-7-5-18(6-8-20)4-3-12-24/h3-10,14,21,25-26H,11,13,15-17H2,1-2H3
InChiKey MHUXGGYIKSYDCR-UHFFFAOYSA-N
Formula C23H28N2O4 Molecular Weight 396.48
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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