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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	CHEMBL65939
Molecular formula	C31H31NO7
IUPAC name	3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[[3-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]furan-2-one
Molecular weight	529.589
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	4.5
Synonyms	3-(1,3-Benzodioxole-5-yl)-4-[3-(2-pyrrolizinoethoxy)benzyl]-5-hydroxy-5-(4-methoxyphenyl)-2(5H)-furanone BDBM50077937 SCHEMBL7956503 3-Benzo[1,3]dioxol-5-yl-5-hydroxy-5-(4-methoxy-phenyl)-4-[3-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-5H-furan-2-one
Inchi Key	BCGHSMJUTFDZQE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C31H31NO7/c1-35-24-10-8-23(9-11-24)31(34)26(29(30(33)39-31)22-7-12-27-28(19-22)38-20-37-27)18-21-5-4-6-25(17-21)36-16-15-32-13-2-3-14-32/h4-12,17,19,34H,2-3,13-16,18,20H2,1H3
PubChem CID	10673756
ChEMBL	CHEMBL65939
IUPHAR	N/A
BindingDB	50077937
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
20154	Endothelin receptor type B	P24530	EDNRB	Homo sapiens (Human)	442
20155	Endothelin-1 receptor	P25101	EDNRA	Homo sapiens (Human)	427

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