CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00488530" 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 CFAMM00488530
Family CFFBM29281 Beta-secretase 1 and Beta-secretase 2 inhibitor AGN-PC-076LAV family
Superfamily CFSBM1360 Beta-secretase 1 and Beta-secretase 2 Binder Superfamily 4
Class CFCAD513 Class 513
External ID CHEMBL583608 External Source CHEMBL
PubChem CID 44478659 Functional Category Bioactive
Molecule Name AGN-PC-076LAY
IUPAC Name 8-(1,3-benzodioxol-5-yl)-8-[3-(2-fluoropyridin-3-yl)phenyl]-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
Synonyms SureCN4069366;CHEBI:674514;8-(1,3-benzodioxol-5-yl)-8-[3-(2-fluoropyridin-3-yl)phenyl]-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
InChi InChI=1S/C24H20FN5O2/c25-21-18(6-2-9-27-21)15-4-1-5-16(12-15)24(17-7-8-19-20(13-17)32-14-31-19)22-28-10-3-11-30(22)23(26)29-24/h1-2,4-9,12-13H,3,10-11,14H2,(H2,26,29)
InChiKey KRRNBJQBFJHWFJ-UHFFFAOYSA-N
Formula C24H20FN5O2 Molecular Weight 429.45
Cross Link CHEMBL583608
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
 

 

27620 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', 'CFAMM00488530'),None, txtsearch, CFAMM00488530|