CFam Chemical Families Database
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You are searching for "CFAMM00320860" 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 CFAMM00320860
Family CFFBM1227 Beta-1 adrenergic receptor and Beta-2 adrenergic receptor ligand ethyl 2-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carboxylate family
Superfamily CFSBM599 Beta-1 adrenergic receptor and Beta-2 adrenergic receptor Binder Superfamily 2
Class CFCCD162 Class 975
External ID 57238185 External Source PubChem
PubChem CID 57238185 Functional Category Patent Compound
Molecule Name AGN-PC-0BQ3L0
IUPAC Name 3-[3-butyl-4-(5-formyl-1H-imidazol-2-yl)phenoxy]propanoic acid
Synonyms 3-[3-butyl-4-(5-formyl-1H-imidazol-2-yl)phenoxy]propanoic acid
InChi InChI=1S/C17H20N2O4/c1-2-3-4-12-9-14(23-8-7-16(21)22)5-6-15(12)17-18-10-13(11-20)19-17/h5-6,9-11H,2-4,7-8H2,1H3,(H,18,19)(H,21,22)
InChiKey KHVGEKXYHDQOHD-UHFFFAOYSA-N
Formula C17H20N2O4 Molecular Weight 316.35
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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