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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	CHEMBL603861
Molecular formula	C21H20F2N4O4
IUPAC name	8-[(2,6-difluorophenyl)methyl]-3-(furan-2-ylmethyl)-1-(2-methoxyethyl)-7-methylpurine-2,6-dione
Molecular weight	430.412
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	2.2
Synonyms	BDBM50415179
Inchi Key	ACRHQCILRCGEKI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20F2N4O4/c1-25-17(11-14-15(22)6-3-7-16(14)23)24-19-18(25)20(28)26(8-10-30-2)21(29)27(19)12-13-5-4-9-31-13/h3-7,9H,8,10-12H2,1-2H3
PubChem CID	46227974
ChEMBL	CHEMBL603861
IUPHAR	N/A
BindingDB	50415179
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
1816	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
1817	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
1815	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
441739	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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