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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	CHEMBL181687
Molecular formula	C25H33NO2
IUPAC name	2-methyl-N-[3-[(2R)-2-(4-phenylbutyl)-2,3-dihydro-1-benzofuran-4-yl]propyl]propanamide
Molecular weight	379.544
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	6.2
Synonyms	BDBM50161384 N-{3-[(R)-2-(4-Phenyl-butyl)-2,3-dihydro-benzofuran-4-yl]-propyl}-isobutyramide
Inchi Key	BDZIORYHQPNRQW-JOCHJYFZSA-N
Inchi ID	InChI=1S/C25H33NO2/c1-19(2)25(27)26-17-9-14-21-13-8-16-24-23(21)18-22(28-24)15-7-6-12-20-10-4-3-5-11-20/h3-5,8,10-11,13,16,19,22H,6-7,9,12,14-15,17-18H2,1-2H3,(H,26,27)/t22-/m1/s1
PubChem CID	44389839
ChEMBL	CHEMBL181687
IUPHAR	N/A
BindingDB	50161384
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
21363	Melatonin receptor type 1A	P48039	MTNR1A	Homo sapiens (Human)	350
21362	Melatonin receptor type 1B	P49286	MTNR1B	Homo sapiens (Human)	362

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