CFam Chemical Families Database
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You are searching for "CFAMM00317250" 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 CFAMM00317250
Family CFFBM920 Metabotropic glutamate receptor 1 and Metabotropic glutamate receptor 5 ligand CHEMBL2205921 family
Superfamily CFSBM527 Metabotropic glutamate receptor 1 and Binder Superfamily
Class CFCAD427 Class 427
External ID CHEMBL1784081 External Source CHEMBL
PubChem CID 54582007 Functional Category Bioactive
Molecule Name AGN-PC-0A9R73
IUPAC Name 9-(3-ethylpent-1-yn-3-ylamino)-3-(4-methylphenyl)pyrido[1,2]thieno[3,4-d]pyrimidin-4-one
Synonyms CHEBI:1250754;9-(3-ethylpent-1-yn-3-ylamino)-3-(4-methylphenyl)pyrido[1,2]thieno[3,4-d]pyrimidin-4-one
InChi InChI=1S/C23H22N4OS/c1-5-23(6-2,7-3)26-17-12-13-24-21-18(17)19-20(29-21)22(28)27(14-25-19)16-10-8-15(4)9-11-16/h1,8-14H,6-7H2,2-4H3,(H,24,26)
InChiKey GHOCNERUVFSDFF-UHFFFAOYSA-N
Formula C23H22N4OS Molecular Weight 402.51
Cross Link CHEMBL1784081
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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