CFam Chemical Families Database
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You are searching for "CFAMM00455365" 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 CFAMM00455365
Family CFFBM20321 Adenosine receptor A1 and Adenosine receptor A2a ligand AGN-PC-09M6IS family
Superfamily CFSBM4857 Metabotropic glutamate receptor 5 and Menin Binder Superfamily
Class CFCCD473 Class 1286
External ID CHEMBL1277025 External Source CHEMBL
PubChem CID 52944665 Functional Category Bioactive
Molecule Name AGN-PC-09M6IS
IUPAC Name 3-benzyl-9-phenyl-1-pyridin-4-ylpyrazolo[2,3]pyrimido[2,3-b]pyridazin-4-one
Synonyms CHEBI:812997;3-benzyl-9-phenyl-1-pyridin-4-ylpyrazolo[2,3]pyrimido[2,3-b]pyridazin-4-one
InChi InChI=1S/C26H18N6O/c33-26-25-23(22-15-21(29-32(22)17-28-25)19-9-5-2-6-10-19)24(20-11-13-27-14-12-20)30-31(26)16-18-7-3-1-4-8-18/h1-15,17H,16H2
InChiKey CIPQSILBAUCAIX-UHFFFAOYSA-N
Formula C26H18N6O Molecular Weight 430.46
Cross Link CHEMBL1277025
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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