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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	Pyrimidin-4-ylacetamide, 6
Molecular formula	C22H29N7O2
IUPAC name	N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-(4-ethylpiperazin-1-yl)acetamide
Molecular weight	423.521
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.2
Synonyms	CHEMBL409420 SCHEMBL1489742 BDBM21192 N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-(4-ethylpiperazin-1-yl)acetamide
Inchi Key	ADUMYZLFDDEFPS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H29N7O2/c1-5-27-8-10-28(11-9-27)14-21(30)23-19-13-20(29-16(3)12-15(2)26-29)25-22(24-19)18-7-6-17(4)31-18/h6-7,12-13H,5,8-11,14H2,1-4H3,(H,23,24,25,30)
PubChem CID	24768414
ChEMBL	CHEMBL409420
IUPHAR	N/A
BindingDB	21192
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
3106	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
3104	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
3105	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410

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