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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	CHEMBL257256
Molecular formula	C16H18ClN3O2S
IUPAC name	N-[6-[(3-chlorophenyl)methoxy]-2-propylsulfanylpyrimidin-4-yl]acetamide
Molecular weight	351.849
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.9
Synonyms	BDBM21233 N-{6-[(3-chlorophenyl)methoxy]-2-(propylsulfanyl)pyrimidin-4-yl}acetamide 2-mercaptopyrimidine analogue, 5l
Inchi Key	AESHNCRRLLSPTG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H18ClN3O2S/c1-3-7-23-16-19-14(18-11(2)21)9-15(20-16)22-10-12-5-4-6-13(17)8-12/h4-6,8-9H,3,7,10H2,1-2H3,(H,18,19,20,21)
PubChem CID	24768446
ChEMBL	CHEMBL257256
IUPHAR	N/A
BindingDB	21233
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
3815	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
3814	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
3816	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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