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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	MLS000064957
Molecular formula	C17H16N2O3S
IUPAC name	3-(2-hydroxyphenyl)-N-(2-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Molecular weight	328.386
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.9
Synonyms	3-(2-hydroxyphenyl)-N-[2-(methylthio)phenyl]-4,5-dihydro-5-isoxazolecarboxamide BDBM31346 N-(2-methylsulfanylphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-oxazolidine-5-carboxamide (3E)-N-(2-methylsulfanylphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,2-oxazolidine-5-carboxamide AC1NY9JS cid_5771718 STK341228 (3Z)-N-(2-methylsulfanylphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-oxazolidine-5-carboxamide AKOS022070105 SMR000078276 (3E)-N-(2-methylsulfanylphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-oxazolidine-5-carboxamide AC1OBKJ4 HMS2472J13 [3-(2-hydroxyphenyl)(4,5-dihydroisoxazol-5-yl)]-N-(2-methylthiophenyl)carboxam ide 3-(2-hydroxyphenyl)-N-[2-(methylsulfanyl)phenyl]-4,5-dihydro-1,2-oxazole-5-carboxamide BAS 09529482 MolPort-002-014-988 (3E)-3-(6-ketocyclohexa-2,4-dien-1-ylidene)-N-[2-(methylthio)phenyl]isoxazolidine-5-carboxamide AC1NX0CY CHEMBL1562802 ST076061 (3E)-N-[2-(methylthio)phenyl]-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-5-isoxazolidinecarboxamide AKOS000559842 MCULE-2495819410 [ Show all ]
Inchi Key	FIYZHRFIVIPMNK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H16N2O3S/c1-23-16-9-5-3-7-12(16)18-17(21)15-10-13(19-22-15)11-6-2-4-8-14(11)20/h2-9,15,20H,10H2,1H3,(H,18,21)
PubChem CID	2962265
ChEMBL	CHEMBL1562802
IUPHAR	N/A
BindingDB	31346
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
559768	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
559769	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378

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