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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	CHEMBL224718
Molecular formula	C23H25ClN6
IUPAC name	3-[(2-chlorophenyl)methyl]-N-hexyl-5-phenyltriazolo[4,5-d]pyrimidin-7-amine
Molecular weight	420.945
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	6.3
Synonyms	BDBM50196016 3-(2-chlorobenzyl)-N-hexyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Inchi Key	ARBBOHNBMWZRMR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H25ClN6/c1-2-3-4-10-15-25-22-20-23(27-21(26-22)17-11-6-5-7-12-17)30(29-28-20)16-18-13-8-9-14-19(18)24/h5-9,11-14H,2-4,10,15-16H2,1H3,(H,25,26,27)
PubChem CID	16111752
ChEMBL	CHEMBL224718
IUPHAR	N/A
BindingDB	50196016
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
12274	Adenosine receptor A1	P28190	ADORA1	Bos taurus (Bovine)	326
12275	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
442170	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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