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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	MLS003115968
Molecular formula	C21H20N2O3S3
IUPAC name	methyl 5-[[2-[(3-methylsulfanylphenyl)carbamothioylamino]phenyl]sulfanylmethyl]furan-2-carboxylate
Molecular weight	444.582
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	4.9
Synonyms	NSC319421 CHEMBL2140171 MCULE-7575479322 ZINC1048546 MolPort-002-889-069 AC1MDVH8 HMS542I14 Oprea1_817289 methyl 5-[[2-[(3-methylsulfanylphenyl)carbamothioylamino]phenyl]sulfanylmethyl]furan-2-carboxylate NSC-319421 Maybridge1_000366 SMR001831528 [ Show all ]
Inchi Key	ABIFLJSKXNDKFA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20N2O3S3/c1-25-20(24)18-11-10-15(26-18)13-29-19-9-4-3-8-17(19)23-21(27)22-14-6-5-7-16(12-14)28-2/h3-12H,13H2,1-2H3,(H2,22,23,27)
PubChem CID	2796363
ChEMBL	CHEMBL2140171
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
878	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
463055	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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