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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	CHEMBL338723
Molecular formula	C17H19N5OS2
IUPAC name	2-(4-methylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidin-6-yl)sulfanylpentanamide
Molecular weight	373.493
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.8
Synonyms	2-(4-Methylsulfanyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6-ylsulfanyl)-pentanoic acid amide BDBM50053937 2-[[1-Phenyl-4-(methylthio)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]pentanamide
Inchi Key	AWVAXCYPDMVCFO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H19N5OS2/c1-3-7-13(14(18)23)25-17-20-15-12(16(21-17)24-2)10-19-22(15)11-8-5-4-6-9-11/h4-6,8-10,13H,3,7H2,1-2H3,(H2,18,23)
PubChem CID	10761899
ChEMBL	CHEMBL338723
IUPHAR	N/A
BindingDB	50053937
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
16391	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
16390	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410

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