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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	MLS001017993
Molecular formula	C24H25FN4O2
IUPAC name	3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-one
Molecular weight	420.488
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	2.8
Synonyms	3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-one HMS2760G16 MolPort-004-001-454 AC1M693V ZINC3226123 3-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one MCULE-9071224948 SMR000354242 AKOS001865466 3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-12-one CHEMBL1345858 717130-76-2 Z30619054 CCG-32501 [ Show all ]
Inchi Key	AEKVTGDIDFGDJN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H25FN4O2/c25-18-6-8-19(9-7-18)27-12-14-28(15-13-27)23(30)17-5-10-20-21(16-17)26-22-4-2-1-3-11-29(22)24(20)31/h5-10,16H,1-4,11-15H2
PubChem CID	2344312
ChEMBL	CHEMBL1345858
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
3579	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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