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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	SMR000073214
Molecular formula	C17H17N3O6S
IUPAC name	dimethyl 5-[[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzene-1,3-dicarboxylate
Molecular weight	391.398
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	1.2
Synonyms	AKOS005698779 HMS2483E12 dimethyl 5-({[(4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetyl}amino)benzene-1,3-dicarboxylate MLS000088954 STL045808 AC1M0DE0 dimethyl 5-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)thio]acetyl}amino)isophthalate MolPort-001-558-477 MCULE-6996694920 ST50764099 dimethyl 5-({[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)thio]acetyl}amino)isophthalate MLS002541753 ZINC18254399 AKOS001689624 dimethyl 5-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzene-1,3-dicarboxylate SCHEMBL14285631 CHEMBL1312149 methyl 3-(methoxycarbonyl)-5-[2-(6-methyl-4-oxo(3-hydropyrimidin-2-ylthio))ace tylamino]benzoate STK149699 587006-76-6 dimethyl 5-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzene-1,3-dicarboxylate MolPort-000-753-615 [ Show all ]
Inchi Key	ACEHGLDUDSPAPV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H17N3O6S/c1-9-4-13(21)20-17(18-9)27-8-14(22)19-12-6-10(15(23)25-2)5-11(7-12)16(24)26-3/h4-7H,8H2,1-3H3,(H,19,22)(H,18,20,21)
PubChem CID	135448852
ChEMBL	CHEMBL1312149
IUPHAR	N/A
BindingDB	N/A
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
463139	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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