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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	CHEMBL67228
Molecular formula	C14H14N4O2
IUPAC name	3-methyl-1-(2-phenylethyl)-7H-purine-2,6-dione
Molecular weight	270.292
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	1.9
Synonyms	BDBM50113247 D0B9CC 3-Methyl-1-phenethyl-3,7-dihydro-purine-2,6-dione
Inchi Key	FVUNKKIGHICYFX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H14N4O2/c1-17-12-11(15-9-16-12)13(19)18(14(17)20)8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,15,16)
PubChem CID	10869347
ChEMBL	CHEMBL67228
IUPHAR	N/A
BindingDB	50113247
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
88528	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
88529	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
88526	Adenosine receptor A2b	P29276	Adora2b	Rattus norvegicus (Rat)	332
88527	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
88530	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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