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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	CHEMBL566040
Molecular formula	C24H29N5O2S
IUPAC name	N-[(6-methylpyridin-2-yl)methyl]-4-morpholin-4-yl-6-(4,5,6,7-tetrahydro-1,3-benzoxazol-2-ylsulfanylmethyl)pyridin-2-amine
Molecular weight	451.589
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	3.6
Synonyms	BDBM50301208 N-((6-methylpyridin-2-yl)methyl)-4-morpholino-6-((4,5,6,7-tetrahydrobenzo[d]oxazol-2-ylthio)methyl)pyridin-2-amine
Inchi Key	BPJLIMPTBHRRCY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H29N5O2S/c1-17-5-4-6-18(26-17)15-25-23-14-20(29-9-11-30-12-10-29)13-19(27-23)16-32-24-28-21-7-2-3-8-22(21)31-24/h4-6,13-14H,2-3,7-12,15-16H2,1H3,(H,25,27)
PubChem CID	45487434
ChEMBL	CHEMBL566040
IUPHAR	N/A
BindingDB	50301208
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
29633	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384

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