CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00303983" 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 CFAMM00303983
Family CFFID4194 Gamma-secretase subunit APH-1B and Presenilin-1 Inhibitor 311440 Family
Superfamily CFSAD675 Serum albumin Inhibitor Gadobenate Dimeglumine Superfamily
Class CFCAD610 Class 610
External ID CHEMBL288005 External Source CHEMBL
PubChem CID 44288090 Functional Category Bioactive
Molecule Name [(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-methylbutanoyl]amino]-3-methoxy-3-oxopropyl] 4-methylbenzoate
IUPAC Name [(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-methylbutanoyl]amino]-3-methoxy-3-oxopropyl] 4-methylbenzoate
Synonyms CHEBI:161569
InChi InChI=1S/C20H29N3O6S/c1-11(2)16(23-17(24)14(21)10-30)18(25)22-15(20(27)28-4)9-29-19(26)13-7-5-12(3)6-8-13/h5-8,11,14-16,30H,9-10,21H2,1-4H3,(H,22,25)(H,23,24)/t14-,15-,16-/m0/s1
InChiKey FRSFADOLCKIPKG-JYJNAYRXSA-N
Formula C20H29N3O6S Molecular Weight 439.53
Cross Link CHEMBL288005
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
 

 

26842 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', 'CFAMM00303983'),None, txtsearch, CFAMM00303983|