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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	CHEMBL111775
Molecular formula	C22H27N3O4S
IUPAC name	N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-(2-phenylethoxy)propanamide
Molecular weight	429.535
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	2.2
Synonyms	BDBM50418830
Inchi Key	CMOORUPKABTWGD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H27N3O4S/c26-18-7-6-17(21-20(18)25-22(28)30-21)8-11-23-12-13-24-19(27)10-15-29-14-9-16-4-2-1-3-5-16/h1-7,23,26H,8-15H2,(H,24,27)(H,25,28)
PubChem CID	44339091
ChEMBL	CHEMBL111775
IUPHAR	N/A
BindingDB	50418830
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
45542	Beta-2 adrenergic receptor	Q8K4Z4	Adrb2	Cavia porcellus (Guinea pig)	418
45544	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
45543	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443

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