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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	CHEMBL1771110
Molecular formula	C28H33N3O2S
IUPAC name	2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-6-thiophen-2-yl-3,4-dihydroisoquinolin-1-one
Molecular weight	475.651
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	5.1
Synonyms	BDBM50342704 3,4-Dihydro-2-[4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl]-6-(2-thienyl)isoquinolin-1(2H)-one
Inchi Key	AMJCGARHMZJBKQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H33N3O2S/c1-33-26-8-3-2-7-25(26)30-18-16-29(17-19-30)13-4-5-14-31-15-12-22-21-23(27-9-6-20-34-27)10-11-24(22)28(31)32/h2-3,6-11,20-21H,4-5,12-19H2,1H3
PubChem CID	46893146
ChEMBL	CHEMBL1771110
IUPHAR	N/A
BindingDB	50342704
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
8940	5-hydroxytryptamine receptor 2A	P50129	HTR2A	Sus scrofa (Pig)	470
8939	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
8938	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
8937	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
521710	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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