CFam Chemical Families Database
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You are searching for "CFAMM00478229" in compound.

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CFAM Mol ID CFAMM00478229
Family CFFBM26358 Small conductance calcium-activated potassium channel protein 3 ligand N-[3-[2,3-bis[3-[(1-ethylquinolin-1-ium-4-yl)amino]propoxy]phenoxy]propyl]-1-ethylquinolin-1-ium-4-amine family
Superfamily CFSBM10263 Small conductance calcium-activated potassium channel protein 3 and Small conductance calcium-activated potassium channel protein 2 Binder Superfamily
Class CFCAD24 Class 24
External ID CHEMBL229216 External Source CHEMBL
PubChem CID 44424251 Functional Category Bioactive
Molecule Name N-[3-[2,3-bis[3-[(1-ethylquinolin-1-ium-4-yl)amino]propoxy]phenoxy]propyl]-1-ethylquinolin-1-ium-4-amine
IUPAC Name N-[3-[2,3-bis[3-[(1-ethylquinolin-1-ium-4-yl)amino]propoxy]phenoxy]propyl]-1-ethylquinolin-1-ium-4-amine
Synonyms CHEBI:480230
InChi InChI=1S/C48H54N6O3/c1-4-52-31-25-40(37-17-7-10-20-43(37)52)49-28-14-34-55-46-23-13-24-47(56-35-15-29-50-41-26-32-53(5-2)44-21-11-8-18-38(41)44)48(46)57-36-16-30-51-42-27-33-54(6-3)45-22-12-9-19-39(42)45/h7-13,17-27,31-33H,4-6,14-16,28-30,34-36H2,1-3H3/p+3
InChiKey ITTXAYWHSICSOX-UHFFFAOYSA-Q
Formula C48H57N6O3 Molecular Weight 766.00
Cross Link CHEMBL229216
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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