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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	MLS003130160
Molecular formula	C26H34N2O5S
IUPAC name	N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclopropanecarboxamide
Molecular weight	486.627
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.4
Synonyms	BRD-K05458033-001-02-7 SMR001834606 BRD-K05458033-001-01-9 CHEMBL1978672
Inchi Key	AEBIAWZHDKLWPF-AXHZCLLHSA-N
Inchi ID	InChI=1S/C26H34N2O5S/c1-17-7-5-6-8-22(17)21-11-12-25-23(13-21)33-24(15-27(4)26(30)20-9-10-20)18(2)14-28(19(3)16-29)34(25,31)32/h5-8,11-13,18-20,24,29H,9-10,14-16H2,1-4H3/t18-,19-,24+/m0/s1
PubChem CID	46903558
ChEMBL	CHEMBL1978672
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
3297	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
463281	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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