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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL26406
Molecular formula	C12H14N4O2
IUPAC name	7-methyl-1,3-bis(prop-2-enyl)purine-2,6-dione
Molecular weight	246.27
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	1.2
Synonyms	1,3-diallyl-7-methylxanthine BDBM50025574 1,3-Di(2-propenyl)-7-methylxanthine D06YJN 102284-65-1 1,3-Diallyl-7-methyl-3,7-dihydro-purine-2,6-dione [ Show all ]
Inchi Key	YAUBCZNTZIWFJS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H14N4O2/c1-4-6-15-10-9(14(3)8-13-10)11(17)16(7-5-2)12(15)18/h4-5,8H,1-2,6-7H2,3H3
PubChem CID	44459941
ChEMBL	CHEMBL26406
IUPHAR	N/A
BindingDB	50025574
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
405557	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
405555	Adenosine receptor A2a	P46616	ADORA2A	Cavia porcellus (Guinea pig)	409
405556	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332

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