CFam Chemical Families Database
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You are searching for "CFAMM00212557" in compound.

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CFAM Mol ID CFAMM00212557
Family CFFID501 5-hydroxytryptamine receptor 2B Ligand Sb 206553 Family
Superfamily CFSCD482 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform and Serine/threonine-protein kinase mTOR Inhibitor BEZ235 Superfamily
Class CFCAD147 Class 147
External ID CHEMBL564501 External Source CHEMBL
PubChem CID 11634886 Functional Category Bioactive
Molecule Name AGN-PC-00D3TB
IUPAC Name 2-(pyridin-3-ylmethyl)-N-[1-[[1-[4-(trifluoromethyl)phenyl]pyrrol-3-yl]methyl]piperidin-4-yl]pyrrolidine-1-carboxamide
Synonyms SureCN4915744;CHEBI:655804;2-(pyridin-3-ylmethyl)-N-[1-[[1-[4-(trifluoromethyl)phenyl]pyrrol-3-yl]methyl]piperidin-4-yl]pyrrolidine-1-carboxamide
InChi InChI=1S/C28H32F3N5O/c29-28(30,31)23-5-7-25(8-6-23)35-16-9-22(20-35)19-34-14-10-24(11-15-34)33-27(37)36-13-2-4-26(36)17-21-3-1-12-32-18-21/h1,3,5-9,12,16,18,20,24,26H,2,4,10-11,13-15,17,19H2,(H,33,37)
InChiKey MINVVCXPGANHIA-UHFFFAOYSA-N
Formula C28H32F3N5O Molecular Weight 511.58
Cross Link CHEMBL564501
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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