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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	CHEMBL3775473
Molecular formula	C23H19FN2O4S2
IUPAC name	6-[(3-fluoro-6H-benzo[c][1,5]benzoxazepin-11-yl)sulfonyl]-4,4-dimethyl-1H-3,1-benzoxazine-2-thione
Molecular weight	470.533
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.2
Synonyms	BDBM50154361 J3.558.004B 6-(8-Fluoro-5,11-dihydrodibenzo[b,e][1,4]oxazepine-5-ylsulfonyl)-4,4-dimethyl-4H-3,1-benzooxazine-2(1H)-thione
Inchi Key	AXXQTTPUMYEBOV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H19FN2O4S2/c1-23(2)17-12-16(8-9-18(17)25-22(31)30-23)32(27,28)26-19-6-4-3-5-14(19)13-29-21-11-15(24)7-10-20(21)26/h3-12H,13H2,1-2H3,(H,25,31)
PubChem CID	127029884
ChEMBL	CHEMBL3775473
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
521985	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
521987	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
521986	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487

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