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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	CHEMBL1682855
Molecular formula	C20H28N4
IUPAC name	N'-[(4-methylpyridin-2-yl)methyl]-N'-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
Molecular weight	324.472
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.1
Synonyms	rac-N1-((4-methylpyridin-2-yl)methyl)-N1-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine BDBM50337562 N'-[(4-methyl-2-pyridyl)methyl]-N'-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine SCHEMBL12935172 N-[(4-Methylpyridin-2-yl)methyl]-N-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
Inchi Key	AOYOMCFAVFSUJS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H28N4/c1-16-9-12-22-18(14-16)15-24(13-3-2-10-21)19-8-4-6-17-7-5-11-23-20(17)19/h5,7,9,11-12,14,19H,2-4,6,8,10,13,15,21H2,1H3
PubChem CID	53319745
ChEMBL	CHEMBL1682855
IUPHAR	N/A
BindingDB	50337562
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
10756	C-X-C chemokine receptor type 4	P61073	CXCR4	Homo sapiens (Human)	352

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