CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00219890" 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 CFAMM00219890
Family CFFID854 Cathepsin F and Cruzipain Inhibitor Benzoyl-arginine-alanine-methyl Ketone Family
Superfamily CFSID698 Cruzipain and Cathepsin S Binder Superfamily
Class CFCCD382 Class 1195
External ID CHEMBL186691 External Source CHEMBL
PubChem CID 44395397 Functional Category Bioactive
Molecule Name 5-fluoro-3-[[(2S)-3-methyl-2-[(4-oxo-4-phenylmethoxybutanoyl)amino]butanoyl]amino]-4-oxopentanoic acid
IUPAC Name 5-fluoro-3-[[(2S)-3-methyl-2-[(4-oxo-4-phenylmethoxybutanoyl)amino]butanoyl]amino]-4-oxopentanoic acid
Synonyms CHEBI:410525
InChi InChI=1S/C21H27FN2O7/c1-13(2)20(21(30)23-15(10-18(27)28)16(25)11-22)24-17(26)8-9-19(29)31-12-14-6-4-3-5-7-14/h3-7,13,15,20H,8-12H2,1-2H3,(H,23,30)(H,24,26)(H,27,28)/t15?,20-/m0/s1
InChiKey VCAPJAONADDXIA-MBABXSBOSA-N
Formula C21H27FN2O7 Molecular Weight 438.45
Cross Link CHEMBL186691
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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