CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00492057" 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.

Search Results

CFAM Mol ID CFAMM00492057
Family CFFBM30506 Farnesyl pyrophosphate synthase inhibitor AGN-PC-080IBX family
Superfamily CFSBM6337 Farnesyl pyrophosphate synthase and Neprilysin Binder Superfamily
Class CFCCD303 Class 1116
External ID CHEMBL1258422 External Source CHEMBL
PubChem CID 46945064 Functional Category Bioactive
Molecule Name AGN-PC-080IBY
IUPAC Name [1-fluoro-1-phosphono-2-[5-(1H-pyrazol-4-yl)pyridin-3-yl]ethyl]phosphonic acid
Synonyms CHEBI:807432;[1-fluoro-1-phosphono-2-[5-(1H-pyrazol-4-yl)pyridin-3-yl]ethyl]phosphonic acid
InChi InChI=1S/C10H12FN3O6P2/c11-10(21(15,16)17,22(18,19)20)2-7-1-8(4-12-3-7)9-5-13-14-6-9/h1,3-6H,2H2,(H,13,14)(H2,15,16,17)(H2,18,19,20)
InChiKey AOQKAONFTODMIY-UHFFFAOYSA-N
Formula C10H12FN3O6P2 Molecular Weight 351.16
Cross Link CHEMBL1258422
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
 

 

26416 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00492057'),None, txtsearch, CFAMM00492057|