CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00155526" 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 CFAMM00155526
Family CFFCD403 5-hydroxytryptamine receptor 3A Ligand DDP-225 Family
Superfamily CFSCD366 5-hydroxytryptamine receptor 3A Ligand DDP-225 Superfamily
Class CFCCD266 Class 1079
External ID 57024599 External Source PubChem
PubChem CID 57024599 Functional Category Patent Compound
Molecule Name AGN-PC-0BKWKD
IUPAC Name ethyl [1-[4-[(4-fluorophenyl)methylamino]-6-methylthieno[2,3-d]pyrimidin-2-yl]piperidin-4-yl] carbonate
Synonyms SureCN7019931;ethyl [1-[4-[(4-fluorophenyl)methylamino]-6-methylthieno[2,3-d]pyrimidin-2-yl]piperidin-4-yl] carbonate
InChi InChI=1S/C22H25FN4O3S/c1-3-29-22(28)30-17-8-10-27(11-9-17)21-25-19(18-12-14(2)31-20(18)26-21)24-13-15-4-6-16(23)7-5-15/h4-7,12,17H,3,8-11,13H2,1-2H3,(H,24,25,26)
InChiKey QPKLHDGXEUKIKE-UHFFFAOYSA-N
Formula C22H25FN4O3S Molecular Weight 444.52
Cross Link
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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