CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00250132" 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.

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CFAM Mol ID CFAMM00250132
Family CFFID1771 Cathepsin B and Cathepsin K Inhibitor L-006235-1 Family
Superfamily CFSID1362 Cathepsin B and Cathepsin K Inhibitor L-006235-1 Superfamily
Class CFCAD804 Class 804
External ID CHEMBL252751 External Source CHEMBL
PubChem CID 5274794 Functional Category Bioactive
Molecule Name AC1NRXA2
IUPAC Name N-[2-(naphthalen-2-ylmethylamino)ethyl]-2-(propanoylamino)-1,3-benzothiazole-6-carboxamide
Synonyms CHEBI:519472;N-[2-(naphthalen-2-ylmethylamino)ethyl]-2-(propanoylamino)-1,3-benzothiazole-6-carboxamide;6-Benzothiazolecarboxamide, N-[2-[(2-naphthalenylmethyl)amino]ethyl]-2-[(1-oxopropyl)amino]-
InChi InChI=1S/C24H24N4O2S/c1-2-22(29)28-24-27-20-10-9-19(14-21(20)31-24)23(30)26-12-11-25-15-16-7-8-17-5-3-4-6-18(17)13-16/h3-10,13-14,25H,2,11-12,15H2,1H3,(H,26,30)(H,27,28,29)
InChiKey HSEWZEAKIXLEPL-UHFFFAOYSA-N
Formula C24H24N4O2S Molecular Weight 432.54
Cross Link CHEMBL252751
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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