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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	Abanoquil
Molecular formula	C22H25N3O4
IUPAC name	2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6,7-dimethoxyquinolin-4-amine
Molecular weight	395.459
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.4
Synonyms	4-Amin-2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolyl)-6,7-dimethoxyquinoline BDBM50033109 SCHEMBL528781 90402-40-7 CTK5G7814 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6,7-dimethoxyquinolin-4-amine AC1L4U65 F738MWY53L 4-Amino-2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolyl)-6,7-dimethoxyquinoline UK 52046 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl) -6,7-dimethoxyquinolin-4-ylamine D0U3HP 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1h)-yl)-6,7-dimethoxyquinolin-4-amine ANZIISNSHPKVRV-UHFFFAOYSA-N L002329 CHEMBL324090 UNII-F738MWY53L 2-(6,7-Dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6,7-dimethoxy-quinolin-4-ylamine Abanoquil [INN:BAN] DTXSID40238163 [ Show all ]
Inchi Key	ANZIISNSHPKVRV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H25N3O4/c1-26-18-7-13-5-6-25(12-14(13)8-19(18)27-2)22-10-16(23)15-9-20(28-3)21(29-4)11-17(15)24-22/h7-11H,5-6,12H2,1-4H3,(H2,23,24)
PubChem CID	164089
ChEMBL	CHEMBL324090
IUPHAR	N/A
BindingDB	50033109
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
10047	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
10049	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
10045	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
10046	Alpha-1D adrenergic receptor	P23944	Adra1d	Rattus norvegicus (Rat)	561
10048	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572

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