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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	CHEMBL168904
Molecular formula	C30H34BrN5O4S
IUPAC name	N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)-2-propylpyrimidin-4-yl]-4-tert-butylbenzenesulfonamide
Molecular weight	640.597
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	7.2
Synonyms	BHSAHNPXJBATRX-UHFFFAOYSA-N N-[2-Propyl-5-(4-methylphenyl)-6-[2-(5-bromo-2-pyrimidinyloxy)ethoxy]-4-pyrimidinyl]-4-(tert-butyl)benzenesulfonamide 4-tert-butyl-N-[6-{2-(5-bromopyrimidin-2-yloxy)ethoxy)-5-(4-methylphenyl)-2-n-propylpyrimidin-4-yl]benzenesulfonamide N-{6-[2-(5-Bromo-pyrimidin-2-yloxy)-ethoxy]-2-propyl-5-p-tolyl-pyrimidin-4-yl}-4-tert-butyl-benzenesulfonamide BDBM50107559 4-tert-butyl-N-[6-{2-(5-bromopyrimidin-2-yloxy)ethoxy}-5-(4-methylphenyl)-2-n-propylpyrimidin-4-yl]benzenesulfonamide SCHEMBL8662342 [ Show all ]
Inchi Key	BHSAHNPXJBATRX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C30H34BrN5O4S/c1-6-7-25-34-27(36-41(37,38)24-14-12-22(13-15-24)30(3,4)5)26(21-10-8-20(2)9-11-21)28(35-25)39-16-17-40-29-32-18-23(31)19-33-29/h8-15,18-19H,6-7,16-17H2,1-5H3,(H,34,35,36)
PubChem CID	19689505
ChEMBL	CHEMBL168904
IUPHAR	N/A
BindingDB	50107559
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
24013	Endothelin-1 receptor	Q29010	EDNRA	Sus scrofa (Pig)	427

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