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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	CHEMBL418193
Molecular formula	C18H22N4O2
IUPAC name	7-benzyl-1,3-dipropylpurine-2,6-dione
Molecular weight	326.4
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	2.9
Synonyms	102284-71-9 7-Benzyl-1,3-dipropyl-3,7-dihydro-purine-2,6-dione PDSP1_001152 BDBM50014262 1H-Purine-2,6-dione, 3,7-dihydro-7-(phenylmethyl)-1,3-dipropyl- CTK0G7690 7-Benzyl-1,3-dipropyl-3,7-dihydro-purine-2,6-dione(7-benzyl-1,3-dipropylxanthine) PDSP2_001136 1,3-Dipropyl-7-benzylxanthine DTXSID10468238 ACMC-20m5ao SCHEMBL1944712 [ Show all ]
Inchi Key	VUCFOFXDFGNTRU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H22N4O2/c1-3-10-21-16-15(17(23)22(11-4-2)18(21)24)20(13-19-16)12-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3
PubChem CID	11537163
ChEMBL	CHEMBL418193
IUPHAR	N/A
BindingDB	50014262
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
364347	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
364348	Adenosine receptor A2a	P46616	ADORA2A	Cavia porcellus (Guinea pig)	409

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