CFam Chemical Families Database
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You are searching for "CFAMM00455426" 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 CFAMM00455426
Family CFFBM20337 Adenosine receptor A1 and Adenosine receptor A2b ligand AGN-PC-08906S family
Superfamily CFSBM7897 Adenosine receptor A1 and Adenosine receptor A2b Binder Superfamily 9
Class CFCBM217 Class 3267
External ID CHEMBL213113 External Source CHEMBL
PubChem CID 11850013 Functional Category Bioactive
Molecule Name AGN-PC-00HFTN
IUPAC Name 3-benzyl-1,6-dimethyl-9-thiophen-3-ylpyrazolo[2,3]pyrimido[2,3-d]pyridazin-4-one
Synonyms CHEBI:456165;3-benzyl-1,6-dimethyl-9-thiophen-3-ylpyrazolo[2,3]pyrimido[2,3-d]pyridazin-4-one
InChi InChI=1S/C21H17N5OS/c1-13-19-18-10-17(16-8-9-28-12-16)24-26(18)14(2)22-20(19)21(27)25(23-13)11-15-6-4-3-5-7-15/h3-10,12H,11H2,1-2H3
InChiKey DCQDGKRFOUXALB-UHFFFAOYSA-N
Formula C21H17N5OS Molecular Weight 387.46
Cross Link CHEMBL213113
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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