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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	CHEMBL116108
Molecular formula	C31H31N5O5S
IUPAC name	4-tert-butyl-N-[6-[2-[5-(furan-2-yl)pyrimidin-2-yl]oxyethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]benzenesulfonamide
Molecular weight	585.679
Hydrogen bond acceptor	10
Hydrogen bond donor	1
XlogP	6.0
Synonyms	N-[5-(4-Methylphenyl)-6-[2-[5-(2-furyl)-2-pyrimidinyloxy]ethoxy]-4-pyrimidinyl]-4-tert-butylbenzenesulfonamide SCHEMBL8801173 L013091
Inchi Key	ABEGYQBNTPEXRM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C31H31N5O5S/c1-21-7-9-22(10-8-21)27-28(36-42(37,38)25-13-11-24(12-14-25)31(2,3)4)34-20-35-29(27)40-16-17-41-30-32-18-23(19-33-30)26-6-5-15-39-26/h5-15,18-20H,16-17H2,1-4H3,(H,34,35,36)
PubChem CID	11050177
ChEMBL	CHEMBL116108
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
771	Endothelin-1 receptor	Q29010	EDNRA	Sus scrofa (Pig)	427

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