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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	CHEMBL372316
Molecular formula	C24H31N5O4S
IUPAC name	1-tert-butyl-3-[1-butyl-2-[(2-methoxy-5-nitrophenyl)methylsulfanyl]benzimidazol-5-yl]urea
Molecular weight	485.603
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	4.8
Synonyms	BDBM50165539 1-tert-Butyl-3-[1-butyl-2-(2-methoxy-5-nitro-benzylsulfanyl)-1H-benzoimidazol-5-yl]-urea
Inchi Key	AKCDWELULNEIRT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H31N5O4S/c1-6-7-12-28-20-10-8-17(25-22(30)27-24(2,3)4)14-19(20)26-23(28)34-15-16-13-18(29(31)32)9-11-21(16)33-5/h8-11,13-14H,6-7,12,15H2,1-5H3,(H2,25,27,30)
PubChem CID	44402471
ChEMBL	CHEMBL372316
IUPHAR	N/A
BindingDB	50165539
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
7425	Gonadotropin-releasing hormone receptor	P30968	GNRHR	Homo sapiens (Human)	328
7426	Gonadotropin-releasing hormone receptor	P30969	Gnrhr	Rattus norvegicus (Rat)	327

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