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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	CHEMBL3827623
Molecular formula	C26H36N6O3
IUPAC name	1,3-dipropyl-9-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Molecular weight	480.613
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.9
Synonyms	BDBM50187586
Inchi Key	ABDRPDMPTGJLDQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H36N6O3/c1-3-12-31-23-22(24(33)32(13-4-2)26(31)34)30-17-7-16-29(25(30)27-23)20-8-10-21(11-9-20)35-19-18-28-14-5-6-15-28/h8-11H,3-7,12-19H2,1-2H3
PubChem CID	127045631
ChEMBL	CHEMBL3827623
IUPHAR	N/A
BindingDB	50187586
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
521465	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
521467	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
521468	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
521469	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
521463	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
521470	Adenosine receptor A2b	P29276	Adora2b	Rattus norvegicus (Rat)	332
521464	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320
521466	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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