CFam Chemical Families Database
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You are searching for "CFAMM00016770" in compound.

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CFAM Mol ID CFAMM00016770
Family CFFAD82 Beta adrenergic receptor ligand naphthol derivative Propranolol family
Superfamily CFSAD80 Adrenergic receptor ligand Propranolol Levobunolol Metipranolol Superfamily
Class CFCAD80 Class 80
External ID 53964375 External Source PubChem
PubChem CID 53964375 Functional Category Patent Compound
Molecule Name AGN-PC-0A13UI
IUPAC Name ethyl-[2-hydroxy-3-(2-phenylphenoxy)propyl]-methyl-propan-2-ylazanium
Synonyms ethyl-[2-hydroxy-3-(2-phenylphenoxy)propyl]-methyl-propan-2-ylazanium
InChi InChI=1S/C21H30NO2/c1-5-22(4,17(2)3)15-19(23)16-24-21-14-10-9-13-20(21)18-11-7-6-8-12-18/h6-14,17,19,23H,5,15-16H2,1-4H3/q+1
InChiKey JNEMADPRARGQCV-UHFFFAOYSA-N
Formula C21H30NO2+ Molecular Weight 328.47
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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