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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	CHEMBL3800341
Molecular formula	C28H32N2O5
IUPAC name	5-hydroxy-8-[2-[2-[3-methoxy-4-(3-phenylpropoxy)phenyl]ethylamino]ethyl]-4H-1,4-benzoxazin-3-one
Molecular weight	476.573
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	4.6
Synonyms	BDBM50167063
Inchi Key	XFQRGEPJIICUBL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H32N2O5/c1-33-25-18-21(9-12-24(25)34-17-5-8-20-6-3-2-4-7-20)13-15-29-16-14-22-10-11-23(31)27-28(22)35-19-26(32)30-27/h2-4,6-7,9-12,18,29,31H,5,8,13-17,19H2,1H3,(H,30,32)
PubChem CID	127047859
ChEMBL	CHEMBL3800341
IUPHAR	N/A
BindingDB	50167063
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
532517	Beta-1 adrenergic receptor	P34971	Adrb1	Mus musculus (Mouse)	466
532515	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
532516	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
532514	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
532513	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
532512	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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