CFam Chemical Families Database
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You are searching for "CFAMM00485446" 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 CFAMM00485446
Family CFFBM28355 C-C chemokine receptor type 2 ligand (E)-N-[(1S,3R)-3-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]cyclopentyl]-3-(3,4,5-trifluorophenyl)prop-2-enamide family
Superfamily CFSBM10799 Retinal dehydrogenase 1 and C-C chemokine receptor type 2 Binder Superfamily
Class CFCAD609 Class 609
External ID CHEMBL400484 External Source CHEMBL
PubChem CID 44444112 Functional Category Bioactive
Molecule Name SureCN4747682
IUPAC Name (E)-3-(3,5-difluorophenyl)-N-[3-[[4-(4-methoxyphenyl)piperidin-1-yl]methyl]cyclopentyl]prop-2-enamide
Synonyms CHEBI:516998
InChi InChI=1S/C27H32F2N2O2/c1-33-26-7-4-21(5-8-26)22-10-12-31(13-11-22)18-20-2-6-25(16-20)30-27(32)9-3-19-14-23(28)17-24(29)15-19/h3-5,7-9,14-15,17,20,22,25H,2,6,10-13,16,18H2,1H3,(H,30,32)/b9-3+
InChiKey VGGAERSVYZEQQX-YCRREMRBSA-N
Formula C27H32F2N2O2 Molecular Weight 454.55
Cross Link CHEMBL400484
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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