CFam Chemical Families Database
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You are searching for "CFAMM00356401" 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 CFAMM00356401
Family CFFBM4473 Cellular tumor antigen p53 and Beta-lactamase inhibitor CHEMBL1413522 family
Superfamily CFSBM2619 GABA theta subunit and Cellular tumor antigen p53 Binder Superfamily
Class CFCCD112 Class 925
External ID CHEMBL482329 External Source CHEMBL
PubChem CID 20770622 Functional Category Bioactive
Molecule Name AGN-PC-02Z2R9
IUPAC Name 3-[5-amino-7-[2-[4-(2,4-difluorophenyl)piperazin-1-yl]ethyl-methylamino]-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]benzonitrile
Synonyms CHEBI:575518;3-[5-amino-7-[2-[4-(2,4-difluorophenyl)piperazin-1-yl]ethyl-methylamino]-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]benzonitrile
InChi InChI=1S/C25H25F2N9/c1-33(7-8-34-9-11-35(12-10-34)21-6-5-19(26)14-20(21)27)22-15-23-30-24(32-36(23)25(29)31-22)18-4-2-3-17(13-18)16-28/h2-6,13-15H,7-12H2,1H3,(H2,29,31)
InChiKey ZPTQAAHWOAPCNM-UHFFFAOYSA-N
Formula C25H25F2N9 Molecular Weight 489.52
Cross Link CHEMBL482329
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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