CFam Chemical Families Database
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You are searching for "CFAMM00449244" 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 CFAMM00449244
Family CFFBM18813 Histamine H3 receptor and Potassium voltage-gated channel subfamily H member 2 ligand AGN-PC-07COA8 family
Superfamily CFSID2078 Histamine H3 receptor Ligand 2-(1,4'-bipiperidin-1'-yl)thiazolo[4,5-b]pyridine Superfamily
Class CFCID1266 Class 2616
External ID CHEMBL578862 External Source CHEMBL
PubChem CID 45482751 Functional Category Bioactive
Molecule Name AGN-PC-07COAU
IUPAC Name 5-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]pyridine-3-carbonitrile
Synonyms SureCN12041339;CHEBI:670881;5-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]pyridine-3-carbonitrile
InChi InChI=1S/C22H24N6S/c23-12-16-10-17(14-24-13-16)18-11-20-21(25-15-18)26-22(29-20)28-8-4-19(5-9-28)27-6-2-1-3-7-27/h10-11,13-15,19H,1-9H2
InChiKey NVAWRPKZEOSLKX-UHFFFAOYSA-N
Formula C22H24N6S Molecular Weight 404.53
Cross Link CHEMBL578862
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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