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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	SMR000628379
Molecular formula	C25H31N3O4S
IUPAC name	1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(3-ethylphenyl)piperidine-4-carboxamide
Molecular weight	469.6
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.0
Synonyms	CHEMBL1396779 MCULE-5026402849 AKOS021731416 MolPort-007-742-755 HMS2256P07 1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-(3-ethylphenyl)piperidine-4-carboxamide MLS001122736 HMS3473A15 AKOS001932630 MLS003880934 [ Show all ]
Inchi Key	AFLURBNFSGNBNT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H31N3O4S/c1-4-19-6-5-7-22(15-19)26-25(30)20-10-12-27(13-11-20)33(31,32)23-8-9-24-21(16-23)14-17(2)28(24)18(3)29/h5-9,15-17,20H,4,10-14H2,1-3H3,(H,26,30)
PubChem CID	20901923
ChEMBL	CHEMBL1396779
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
463409	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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