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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	Methoctramine
Molecular formula	C36H66Cl4N4O2
IUPAC name	N,N'-bis[6-[(2-methoxyphenyl)methylamino]hexyl]octane-1,8-diamine;tetrahydrochloride
Molecular weight	728.75
Hydrogen bond acceptor	6
Hydrogen bond donor	8
XlogP	None
Synonyms	M-105 N,N'-Bis{6-[(2-methoxybenzyl)amino]hexyl}-1,8-octanediamine tetrahydrochloride SR-01000075328-1 EU-0100862 METHOCTRAMINE HYDROCHLORIDE N1,N1'-(octane-1,8-diyl)bis(N6-(2-methoxybenzyl)hexane-1,6-diamine) tetrahydrochloride 1,8-Octanediamine, N,N'-bis(6-(((2-methoxyphenyl)methyl)amino)hexyl)-, tetrahydrochloride LP00862 N,N'-bis[6-[(2-methoxyphenyl)methylamino]hexyl]octane-1,8-diamine tetrahydrochloride RLO2T99XT3 CCG-222166 CHEMBL500996 N,N'-bis{6-[(2-methoxybenzyl)amino]hexyl}octane-1,8-diamine tetrahydrochloride Tox21_500862 J-001258 Methoctramine tetrahydrochloride NCGC00094187-01 104807-46-7 LS-186869 N,N'-bis[6-[[(2-Methoxyphenyl)methyl]amino]hexyl]1,8-octane diamine tetrahydrochloride SR-01000075328 CHEBI:73452 DTXSID40146754 Methoctramine hemihydrate N,N'-bis{6-[(2-methoxybenzyl)azaniumyl]hexyl}octane-1,8-diaminium tetrachloride UNII-RLO2T99XT3 KB-300124 N,N'-Bis(6-((2-methoxybenzyl)amino)hexyl)-1,8-octanediamine tetrahydrochloride NCGC00261547-01 AC1L32PA [ Show all ]
Inchi Key	CDKGGOUDHGSFAF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C36H62N4O2.4ClH/c1-41-35-23-13-11-21-33(35)31-39-29-19-9-7-17-27-37-25-15-5-3-4-6-16-26-38-28-18-8-10-20-30-40-32-34-22-12-14-24-36(34)42-2;;;;/h11-14,21-24,37-40H,3-10,15-20,25-32H2,1-2H3;4*1H
PubChem CID	107759
ChEMBL	CHEMBL500996
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

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
39354	Muscarinic acetylcholine receptor DM1	P16395	mAChR-A	Drosophila melanogaster (Fruit fly)	805
39353	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
39355	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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