CFam Chemical Families Database
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You are searching for "CFAMM00278993" 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 CFAMM00278993
Family CFFID2886 Renin Inhibitor Ro-66-1168 Family
Superfamily CFSID2043 Renin Inhibitor Ro-66-1168 Superfamily
Class CFCCD20 Class 833
External ID CHEMBL195971 External Source CHEMBL
PubChem CID 44402905 Functional Category Bioactive
Molecule Name SureCN6724665
IUPAC Name (6R)-6-[(2-chloro-4-fluorophenyl)methoxymethyl]-1-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperazin-2-one
Synonyms CHEBI:426749
InChi InChI=1S/C29H32ClFN2O5/c1-35-28-6-3-2-5-22(28)19-36-13-4-14-38-26-11-9-24(10-12-26)33-25(16-32-17-29(33)34)20-37-18-21-7-8-23(31)15-27(21)30/h2-3,5-12,15,25,32H,4,13-14,16-20H2,1H3/t25-/m1/s1
InChiKey YTWPNMBYOAHYMX-RUZDIDTESA-N
Formula C29H32ClFN2O5 Molecular Weight 543.03
Cross Link CHEMBL195971
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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