CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00007319" 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 CFAMM00007319
Family CFFAD29 5-hydroxytryptamine receptor 1A ligand azapirone derivative Buspirone Family
Superfamily CFSAD29 5HT receptor binding azapirones Superfamily
Class CFCAD29 Class 29
External ID CHEMBL44837 External Source CHEMBL
PubChem CID 13608253 Functional Category Bioactive
Molecule Name SureCN10911831
IUPAC Name 8-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-dione
Synonyms AGN-PC-00NA06;CHEBI:171530;8-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-dione
InChi InChI=1S/C21H30FN5O2/c22-17-15-23-20(24-16-17)26-11-9-25(10-12-26)7-3-4-8-27-18(28)13-21(14-19(27)29)5-1-2-6-21/h15-16H,1-14H2
InChiKey YWAAPAJFLAZJQK-UHFFFAOYSA-N
Formula C21H30FN5O2 Molecular Weight 403.49
Cross Link CHEMBL44837
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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