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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	CHEMBL3093310
Molecular formula	C19H19N5O2
IUPAC name	9-benzyl-1-methyl-3-prop-2-ynyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Molecular weight	349.394
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	1.7
Synonyms	9-Benzyl-1-methyl-3-(2-propynyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Inchi Key	AXFIBHMJKBPZTM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H19N5O2/c1-3-10-24-17(25)15-16(21(2)19(24)26)20-18-22(11-7-12-23(15)18)13-14-8-5-4-6-9-14/h1,4-6,8-9H,7,10-13H2,2H3
PubChem CID	72697652
ChEMBL	CHEMBL3093310
IUPHAR	N/A
BindingDB	N/A
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
16650	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
16652	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
16649	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
16653	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
16651	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
442314	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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