CFam Chemical Families Database
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You are searching for "CFAMM00421037" 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 CFAMM00421037
Family CFFBM13198 Non-receptor tyrosine-protein kinase TYK2 ligand AGN-PC-0D0YSZ family
Superfamily CFSID1538 Metabotropic glutamate receptor 5 Ligand 3-chloro-n-(6-chloropyridin-2-yl)benzamide Superfamily
Class CFCID987 Class 2337
External ID CHEMBL2387125 External Source CHEMBL
PubChem CID 49839914 Functional Category Bioactive
Molecule Name AGN-PC-088H38
IUPAC Name 2,6-dichloro-N-[2-(cyclopropanecarbonylamino)pyridin-4-yl]-4-ethynylbenzamide
Synonyms 2,6-dichloro-N-[2-(cyclopropanecarbonylamino)pyridin-4-yl]-4-ethynylbenzamide
InChi InChI=1S/C18H13Cl2N3O2/c1-2-10-7-13(19)16(14(20)8-10)18(25)22-12-5-6-21-15(9-12)23-17(24)11-3-4-11/h1,5-9,11H,3-4H2,(H2,21,22,23,24,25)
InChiKey YEWVWLCYFGFAAG-UHFFFAOYSA-N
Formula C18H13Cl2N3O2 Molecular Weight 374.22
Cross Link CHEMBL2387125
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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