CFam Chemical Families Database
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You are searching for "CFAMM00387571" 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 CFAMM00387571
Family CFFBM8385 Metabotropic glutamate receptor 5 ligand [2-[6-(3-chlorophenyl)pyridin-3-yl]pyrrolidin-1-yl]-(1,3-thiazol-5-yl)methanone family
Superfamily CFSBM4504 Metabotropic glutamate receptor 5 Binder Superfamily 8
Class CFCID1065 Class 2415
External ID CHEMBL492105 External Source CHEMBL
PubChem CID 25050395 Functional Category Bioactive
Molecule Name isoquinoline, 46
IUPAC Name N-(3-chlorophenyl)-N-[(7,8-difluoroisoquinolin-4-yl)methyl]-4-methyl-1,3-thiazole-5-carboxamide
Synonyms AGN-PC-04YP0H;SureCN4574279;N-(3-chlorophenyl)-N-[(7,8-difluoroisoquinolin-4-yl)methyl]-4-methyl-1,3-thiazole-5-carboxamide
InChi InChI=1S/C21H14ClF2N3OS/c1-12-20(29-11-26-12)21(28)27(15-4-2-3-14(22)7-15)10-13-8-25-9-17-16(13)5-6-18(23)19(17)24/h2-9,11H,10H2,1H3
InChiKey RPRFXNFGCRVVSZ-UHFFFAOYSA-N
Formula C21H14ClF2N3OS Molecular Weight 429.87
Cross Link CHEMBL492105
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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