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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	SCHEMBL4532006
Molecular formula	C21H23N5O3
IUPAC name	6-(3,5-dimethoxypyridin-4-yl)-1-[[3-(triazol-2-yl)phenyl]methyl]piperidin-2-one
Molecular weight	393.447
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	2.0
Synonyms	US9242970, 67 AFLPVDYCVMAMQP-UHFFFAOYSA-N CHEMBL3946040 1-(3-(2H-1,2,3-triazol-2-yl)benzyl)-6-(3,5-dimethoxypyridin-4-yl)piperidin-2-one BDBM202920
Inchi Key	AFLPVDYCVMAMQP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H23N5O3/c1-28-18-12-22-13-19(29-2)21(18)17-7-4-8-20(27)25(17)14-15-5-3-6-16(11-15)26-23-9-10-24-26/h3,5-6,9-13,17H,4,7-8,14H2,1-2H3
PubChem CID	69080984
ChEMBL	CHEMBL3946040
IUPHAR	N/A
BindingDB	202920
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
536038	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
536037	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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