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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	CHEMBL3644417
Molecular formula	C20H22N4O2
IUPAC name	9-(1-methoxyethyl)-2-(1-methylpyrazol-3-yl)-7,8-dihydro-4H-[1,4]diazepino[7,1-a]isoquinolin-5-one
Molecular weight	350.422
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	1.5
Synonyms	US8853203, 47 AXDXFTQUQRRHCN-UHFFFAOYSA-N BDBM136128 SCHEMBL15488212 9-(1-methoxyethyl)-2-(1-methyl-1H-pyrazol-3-yl)-7,8-dihydro-[1,4]diazepino[7,1-a]isoquinolin-5(4H)-one
Inchi Key	AXDXFTQUQRRHCN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H22N4O2/c1-13(26-3)14-5-4-6-16-15(14)7-10-24-19(16)11-18(21-12-20(24)25)17-8-9-23(2)22-17/h4-6,8-9,11,13H,7,10,12H2,1-3H3
PubChem CID	89980374
ChEMBL	CHEMBL3644417
IUPHAR	N/A
BindingDB	136128
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
517410	Metabotropic glutamate receptor 1	Q13255	GRM1	Homo sapiens (Human)	1194
464934	Metabotropic glutamate receptor 5	P41594	GRM5	Homo sapiens (Human)	1212

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