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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	MLS001116776
Molecular formula	C23H27N3O5S
IUPAC name	6-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]sulfonyl-4H-1,4-benzoxazin-3-one
Molecular weight	457.545
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.9
Synonyms	SMR000627472 7-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}sulfonyl)-2H-1,4-benzoxazin-3(4H)-one MCULE-1254931741 ZINC9440146 AB00859525-06 CHEMBL1462744 AKOS001935481 HMS2942J17 [ Show all ]
Inchi Key	AFORHZFFBKXEFC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H27N3O5S/c1-16-4-3-5-20(17(16)2)25-9-11-26(12-10-25)23(28)8-13-32(29,30)18-6-7-21-19(14-18)24-22(27)15-31-21/h3-7,14H,8-13,15H2,1-2H3,(H,24,27)
PubChem CID	22551349
ChEMBL	CHEMBL1462744
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
4362	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
463417	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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