CFam Chemical Families Database
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You are searching for "CFAMM00279019" in compound.

Total 1 results found.

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 CFAMM00279019
Family CFFID2886 Renin Inhibitor Ro-66-1168 Family
Superfamily CFSID2043 Renin Inhibitor Ro-66-1168 Superfamily
Class CFCCD20 Class 833
External ID CHEMBL424437 External Source CHEMBL
PubChem CID 44342269 Functional Category Bioactive
Molecule Name AGN-PC-074Z2J
IUPAC Name 8-[[4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperidin-3-yl]oxymethyl]-1,2,3,4-tetrahydroquinoline
Synonyms CHEBI:288503;8-[[4-[4-[3-[(2-methoxyphenyl)methoxy]propoxy]phenyl]piperidin-3-yl]oxymethyl]-1,2,3,4-tetrahydroquinoline
InChi InChI=1S/C32H40N2O4/c1-35-30-11-3-2-7-26(30)22-36-19-6-20-37-28-14-12-24(13-15-28)29-16-18-33-21-31(29)38-23-27-9-4-8-25-10-5-17-34-32(25)27/h2-4,7-9,11-15,29,31,33-34H,5-6,10,16-23H2,1H3
InChiKey GRMUUYATJYSIHM-UHFFFAOYSA-N
Formula C32H40N2O4 Molecular Weight 516.67
Cross Link CHEMBL424437
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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