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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	SMR000030768
Molecular formula	C22H24FN3O2S
IUPAC name	1-[[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide
Molecular weight	413.511
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.4
Synonyms	MCULE-9322499632 AC1MMJXW CHEMBL1366806 MLS000095214 1-[[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide AKOS001824425 HMS2414P09 MLS001367712 1-{[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-N-(thien-2-ylmethyl)piperidine-4-carboxamide [ Show all ]
Inchi Key	ABQDJTCVUAGQEB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H24FN3O2S/c1-15-20(25-22(28-15)18-6-2-3-7-19(18)23)14-26-10-8-16(9-11-26)21(27)24-13-17-5-4-12-29-17/h2-7,12,16H,8-11,13-14H2,1H3,(H,24,27)
PubChem CID	3239927
ChEMBL	CHEMBL1366806
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
1073	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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