CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00226090" 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 CFAMM00226090
Family CFFID1047 Beta-secretase 1 Inhibitor N~3~-(3-pyridin-3-ylbenzyl)pyridine-2,3-diamine Family
Superfamily CFSID854 Beta-secretase 1 and Serine/threonine-protein kinase B-raf Binder Superfamily
Class CFCAD144 Class 144
External ID CHEMBL87529 External Source CHEMBL
PubChem CID 15512769 Functional Category Bioactive
Molecule Name SureCN6618161
IUPAC Name 6-[4-[2-[4-(2-phenylethyl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
Synonyms AGN-PC-00PI05;CHEBI:239006;2-Pyridinamine, 6-[4-[2-[4-(2-phenylethyl)-1-piperazinyl]ethyl]phenyl]-
InChi InChI=1S/C25H30N4/c26-25-8-4-7-24(27-25)23-11-9-22(10-12-23)14-16-29-19-17-28(18-20-29)15-13-21-5-2-1-3-6-21/h1-12H,13-20H2,(H2,26,27)
InChiKey JPLKZTMYLGJGRL-UHFFFAOYSA-N
Formula C25H30N4 Molecular Weight 386.53
Cross Link CHEMBL87529
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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