CFam Chemical Families Database
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You are searching for "CFAMM00469765" 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 CFAMM00469765
Family CFFBM24398 Mitogen-activated protein kinase 10 and Mitogen-activated protein kinase 9 inhibitor AGN-PC-09QLGK family
Superfamily CFSBM9653 Mitogen-activated protein kinase 9 and Mitogen-activated protein kinase 10 Binder Superfamily
Class CFCCD361 Class 1174
External ID CHEMBL1784651 External Source CHEMBL
PubChem CID 54584315 Functional Category Bioactive
Molecule Name AGN-PC-0A9SQ9
IUPAC Name 3-[2-(cyclopropylmethylamino)pyridin-4-yl]-4-naphthalen-2-yl-1H-1,2,4-triazole-5-thione
Synonyms CHEBI:1251330;3-[2-(cyclopropylmethylamino)pyridin-4-yl]-4-naphthalen-2-yl-1H-1,2,4-triazole-5-thione
InChi InChI=1S/C21H19N5S/c27-21-25-24-20(17-9-10-22-19(12-17)23-13-14-5-6-14)26(21)18-8-7-15-3-1-2-4-16(15)11-18/h1-4,7-12,14H,5-6,13H2,(H,22,23)(H,25,27)
InChiKey KDXIUKJSJIVWEJ-UHFFFAOYSA-N
Formula C21H19N5S Molecular Weight 373.47
Cross Link CHEMBL1784651
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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