CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00322956" 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 CFAMM00322956
Family CFFBM1393 ALK tyrosine kinase receptor ligand SureCN1600195 family
Superfamily CFSBM793 Reverse transcriptase/RNaseH and ALK tyrosine kinase receptor Binder Superfamily
Class CFCAD144 Class 144
External ID CHEMBL1163567 External Source CHEMBL
PubChem CID 46906793 Functional Category Bioactive
Molecule Name AGN-PC-080QC3
IUPAC Name [4-[1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]phenyl]-(4-methoxypiperidin-1-yl)methanone
Synonyms CHEBI:745506;[4-[1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]phenyl]-(4-methoxypiperidin-1-yl)methanone
InChi InChI=1S/C28H28ClF3N4O2/c1-38-23-8-11-35(12-9-23)27(37)19-4-2-18(3-5-19)20-15-25-26(34-16-20)33-10-13-36(25)17-21-14-22(29)6-7-24(21)28(30,31)32/h2-7,14-16,23H,8-13,17H2,1H3,(H,33,34)
InChiKey VMVVOKCTJMCBIB-UHFFFAOYSA-N
Formula C28H28ClF3N4O2 Molecular Weight 545.00
Cross Link CHEMBL1163567
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
 

 

26384 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', 'CFAMM00322956'),None, txtsearch, CFAMM00322956|