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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	CHEMBL475146
Molecular formula	C23H23N5O3
IUPAC name	2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-[(2-methoxyphenyl)methyl]purin-8-one
Molecular weight	417.469
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.4
Synonyms	BDBM50248262 SCHEMBL4515952 2-(cyclopropylamino)-7-(2-methoxybenzyl)-9-(3-methoxyphenyl)-7H-purin-8(9H)-one
Inchi Key	AQEXTJMLDIXPHI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H23N5O3/c1-30-18-8-5-7-17(12-18)28-21-19(13-24-22(26-21)25-16-10-11-16)27(23(28)29)14-15-6-3-4-9-20(15)31-2/h3-9,12-13,16H,10-11,14H2,1-2H3,(H,24,25,26)
PubChem CID	44564881
ChEMBL	CHEMBL475146
IUPHAR	N/A
BindingDB	50248262
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
11628	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
11626	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
11627	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412

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