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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	AC1LLNFY
Molecular formula	C21H16N2O2S2
IUPAC name	2-[2-(5-methylthiophen-2-yl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one
Molecular weight	392.491
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	5.2
Synonyms	CHEMBL1499477 SR-01000527231-1 2-{[2-(5-methyl-2-thienyl)-2-oxoethyl]thio}-3-phenyl-4(3H)-quinazolinone MLS000575762 ZINC759032 CHEBI:114898 SMR000196798 2-[2-(5-methylthiophen-2-yl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one HMS2339K24 ST047752 2-{[2-(5-methylthiophen-2-yl)-2-oxoethyl]sulfanyl}-3-phenylquinazolin-4(3H)-one AKOS001730025 MolPort-002-229-274 SR-01000527231 2-{[2-(5-methyl-2-thienyl)-2-oxoethyl]sulfanyl}-3-phenyl-4(3H)-quinazolinone A2150/0090316 MCULE-1299258363 STK761631 Cambridge id 6950477 Oprea1_857400 2-[2-(5-methyl(2-thienyl))-2-oxoethylthio]-3-phenyl-3-hydroquinazolin-4-one [ Show all ]
Inchi Key	ACCPBDSGHDRJJU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H16N2O2S2/c1-14-11-12-19(27-14)18(24)13-26-21-22-17-10-6-5-9-16(17)20(25)23(21)15-7-3-2-4-8-15/h2-12H,13H2,1H3
PubChem CID	1070244
ChEMBL	CHEMBL1499477
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
1429	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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