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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	CHEMBL1257381
Molecular formula	C23H19BrN2O2S
IUPAC name	3-[[2-(4-bromophenyl)ethylamino]methyl]-2-thiophen-3-ylquinoline-7-carboxylic acid
Molecular weight	467.381
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.8
Synonyms	KFUJPWYOARIOCE-UHFFFAOYSA-N 3-((4-bromophenethylamino)methyl)-2-(thiophen-3-yl)quinoline-7-carboxylic acid SCHEMBL4741346 BDBM50327536
Inchi Key	KFUJPWYOARIOCE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H19BrN2O2S/c24-20-5-1-15(2-6-20)7-9-25-13-19-11-16-3-4-17(23(27)28)12-21(16)26-22(19)18-8-10-29-14-18/h1-6,8,10-12,14,25H,7,9,13H2,(H,27,28)
PubChem CID	52949831
ChEMBL	CHEMBL1257381
IUPHAR	N/A
BindingDB	50327536
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
168116	G-protein coupled bile acid receptor 1	Q80SS6	Gpbar1	Mus musculus (Mouse)	329
168117	G-protein coupled bile acid receptor 1	Q8TDU6	GPBAR1	Homo sapiens (Human)	330

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