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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	CHEMBL3633894
Molecular formula	C17H17NO2S
IUPAC name	S-[2-oxo-2-(1-phenylethylamino)ethyl] benzenecarbothioate
Molecular weight	299.388
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.6
Synonyms	MCULE-9519417368 BDBM50131897 S-{2-oxo-2-[(1-phenylethyl)amino]ethyl} benzenecarbothioate AC1MEKRZ MolPort-002-159-743 BIM-0026719.P001 ST45097267 2-(phenylcarbonylthio)-N-(phenylethyl)acetamide AKOS024291232 S-[2-oxo-2-(1-phenylethylamino)ethyl] benzenecarbothioate CBMicro_026747 STK031593 [ Show all ]
Inchi Key	NYTPJIOIBBIUIK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H17NO2S/c1-13(14-8-4-2-5-9-14)18-16(19)12-21-17(20)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,18,19)
PubChem CID	2856847
ChEMBL	CHEMBL3633894
IUPHAR	N/A
BindingDB	50131897
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
492141	Probable G-protein coupled receptor 139	Q6DWJ6	GPR139	Homo sapiens (Human)	353

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