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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	CHEMBL138681
Molecular formula	C34H53N7O3
IUPAC name	N-[6-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]hexyl]-N-methyl-4-[[methyl-[6-(methylamino)hexyl]amino]methyl]benzamide
Molecular weight	607.844
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	5.0
Synonyms	BDBM50408676 N-Methyl-N-[6-[methyl(4-amino-6,7-dimethoxyquinazoline-2-yl)amino]hexyl]-4-[[methyl[6-(methylamino)hexyl]amino]methyl]benzamide
Inchi Key	DEJRQWNKBLUKLC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H53N7O3/c1-36-19-11-7-8-12-20-39(2)25-26-15-17-27(18-16-26)33(42)40(3)21-13-9-10-14-22-41(4)34-37-29-24-31(44-6)30(43-5)23-28(29)32(35)38-34/h15-18,23-24,36H,7-14,19-22,25H2,1-6H3,(H2,35,37,38)
PubChem CID	10651334
ChEMBL	CHEMBL138681
IUPHAR	N/A
BindingDB	50408676
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
57824	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466
57826	Alpha-1B adrenergic receptor	P15823	Adra1b	Rattus norvegicus (Rat)	515
57825	Alpha-1D adrenergic receptor	P23944	Adra1d	Rattus norvegicus (Rat)	561

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