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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	CHEMBL1864946
Molecular formula	C23H29N3O3
IUPAC name	N-[2-(1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-2-methylpropanamide
Molecular weight	395.503
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.6
Synonyms	MolPort-003-373-486 HMS1902B18 AKOS002049083 N-[2-(1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-2-methylpropanamide MCULE-7991739308 AKOS021600886 NCGC00135992-01 G856-4225 [ Show all ]
Inchi Key	ABOZICVTOXROBG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H29N3O3/c1-17(2)23(27)24-15-20(18-8-9-21-22(14-18)29-16-28-21)26-12-10-25(11-13-26)19-6-4-3-5-7-19/h3-9,14,17,20H,10-13,15-16H2,1-2H3,(H,24,27)
PubChem CID	16031995
ChEMBL	CHEMBL1864946
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
463080	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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