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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	CHEMBL309518
Molecular formula	C24H27N3O5S2
IUPAC name	3-[1-[4-(5-methylsulfanyl-1,1,3-trioxo-1,2-benzothiazol-2-yl)butyl]piperidin-4-yl]-1,3-benzoxazol-2-one
Molecular weight	501.616
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	3.5
Synonyms	BDBM50071654 SCHEMBL8672673 3-{1-[4-(5-Methylsulfanyl-1,1,3-trioxo-1,3-dihydro-1lambda6-benzo[d]isothiazol-2-yl)-butyl]-piperidin-4-yl}-3H-benzooxazol-2-one
Inchi Key	AACTUBFOGVFADC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H27N3O5S2/c1-33-18-8-9-22-19(16-18)23(28)26(34(22,30)31)13-5-4-12-25-14-10-17(11-15-25)27-20-6-2-3-7-21(20)32-24(27)29/h2-3,6-9,16-17H,4-5,10-15H2,1H3
PubChem CID	19085858
ChEMBL	CHEMBL309518
IUPHAR	N/A
BindingDB	50071654
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
64	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
62	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
63	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572

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