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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	CHEMBL21520
Molecular formula	C20H30N4O
IUPAC name	N'-[2-[(4-methoxyphenyl)methyl-pyridin-2-ylamino]ethyl]-N'-methylbutane-1,4-diamine
Molecular weight	342.487
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.0
Synonyms	CCLXLBBRGDWTKH-UHFFFAOYSA-N N-(4-Methoxybenzyl)-N-[2-[methyl(4-aminobutyl)amino]ethyl]pyridine-2-amine N-[2-[N-(4-methoxybenzyl)-N-(2-pyridyl)amino]ethyl]-N-methyl-1,4-butanediamine BDBM50404166 SCHEMBL9574685
Inchi Key	CCLXLBBRGDWTKH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H30N4O/c1-23(14-6-4-12-21)15-16-24(20-7-3-5-13-22-20)17-18-8-10-19(25-2)11-9-18/h3,5,7-11,13H,4,6,12,14-17,21H2,1-2H3
PubChem CID	19762580
ChEMBL	CHEMBL21520
IUPHAR	N/A
BindingDB	50404166
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
38729	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
38730	Histamine H1 receptor	P31389	HRH1	Cavia porcellus (Guinea pig)	488

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