CFam Chemical Families Database
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You are searching for "CFAMM00362639" in compound.

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CFAM Mol ID CFAMM00362639
Family CFFBM5250 Thyroid hormone receptor beta and Cruzipain ligand CHEMBL1473063 family
Superfamily CFSBM548 Mitogen-activated protein kinase 14 and Tyrosine-protein kinase Lck Binder Superfamily
Class CFCCD443 Class 1256
External ID CHEMBL13830 External Source CHEMBL
PubChem CID 44269252 Functional Category Bioactive
Molecule Name AGN-PC-0746MZ
IUPAC Name 3-[4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-ylbenzamide
Synonyms CHEBI:113638;3-[4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]pyrimidin-2-yl]oxy-N-piperazin-1-ylbenzamide
InChi InChI=1S/C29H31FN8O2/c30-22-6-4-20(5-7-22)26-27(38(19-34-26)23-8-11-31-12-9-23)25-10-13-33-29(35-25)40-24-3-1-2-21(18-24)28(39)36-37-16-14-32-15-17-37/h1-7,10,13,18-19,23,31-32H,8-9,11-12,14-17H2,(H,36,39)
InChiKey GQAYUTWIMYAGRV-UHFFFAOYSA-N
Formula C29H31FN8O2 Molecular Weight 542.61
Cross Link CHEMBL13830
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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