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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Adenosine receptor A2a
Species	Rattus norvegicus (Rat)
Gene	Adora2a
Synonym	A2-AR A2A receptor adenosine receptor A2a RDC8
Disease	N/A for non-human GPCRs
Length	410
Amino acid sequence	MGSSVYITVELAIAVLAILGNVLVCWAVWINSNLQNVTNFFVVSLAAADIAVGVLAIPFAITISTGFCAACHGCLFFACFVLVLTQSSIFSLLAIAIDRYIAIRIPLRYNGLVTGVRAKGIIAICWVLSFAIGLTPMLGWNNCSQKDGNSTKTCGEGRVTCLFEDVVPMNYMVYYNFFAFVLLPLLLMLAIYLRIFLAARRQLKQMESQPLPGERTRSTLQKEVHAAKSLAIIVGLFALCWLPLHIINCFTFFCSTCRHAPPWLMYLAIILSHSNSVVNPFIYAYRIREFRQTFRKIIRTHVLRRQEPFQAGGSSAWALAAHSTEGEQVSLRLNGHPLGVWANGSATHSGRRPNGYTLGLGGGGSAQGSPRDVELPTQERQEGQEHPGLRGHLVQARVGASSWSSEFAPS
UniProt	P30543
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL302
IUPHAR	19
DrugBank	N/A

Ligand

Name	1,3-dibenzyl-3,7-dihydro-1h-purine-2,6-dione
Molecular formula	C19H16N4O2
IUPAC name	1,3-dibenzyl-7H-purine-2,6-dione
Molecular weight	332.363
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.0
Synonyms	BDBM50025573 1H-Purine-2,6-dione,3,9-dihydro-1,3-bis(phenylmethyl)- CTK4G7326 AC1L5IF2 NSC70563 1,3-Dibenzyl-3,7-dihydro-purine-2,6-dione 31542-68-4 D0LM1Q 1,3-Dibenzyl-1H-purine-2,6(3H,7H)-dione AC1Q6LGR SCHEMBL3107001 1,3-dibenzyl-7H-purine-2,6-dione CHEMBL24774 NSC-70563 [ Show all ]
Inchi Key	NHCLZKKZQJJXER-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H16N4O2/c24-18-16-17(21-13-20-16)22(11-14-7-3-1-4-8-14)19(25)23(18)12-15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H,20,21)
PubChem CID	250782
ChEMBL	CHEMBL24774
IUPHAR	N/A
BindingDB	50025573
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	3.6 %	PMID7932565	ChEMBL

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