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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	CHEMBL8677
Molecular formula	C27H27NO6
IUPAC name	(2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-(2-phenoxyethyl)pyrrolidine-3-carboxylic acid
Molecular weight	461.514
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.0
Synonyms	(2S,3S,4R)-4-Benzo[1,3]dioxol-5-yl-2-(4-methoxy-phenyl)-1-(2-phenoxy-ethyl)-pyrrolidine-3-carboxylic acid BDBM50050995 1-(2-Phenoxyethyl)-2alpha-(4-methoxyphenyl)-4alpha-(1,3-benzodioxol-5-yl)pyrrolidine-3beta-carboxylic acid
Inchi Key	BOCLUXAWCZGFFW-UCGXPXSYSA-N
Inchi ID	InChI=1S/C27H27NO6/c1-31-20-10-7-18(8-11-20)26-25(27(29)30)22(19-9-12-23-24(15-19)34-17-33-23)16-28(26)13-14-32-21-5-3-2-4-6-21/h2-12,15,22,25-26H,13-14,16-17H2,1H3,(H,29,30)/t22-,25-,26+/m0/s1
PubChem CID	10790183
ChEMBL	CHEMBL8677
IUPHAR	N/A
BindingDB	50050995
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
28648	Endothelin receptor type B	P35463	EDNRB	Sus scrofa (Pig)	443
28647	Endothelin-1 receptor	P26684	Ednra	Rattus norvegicus (Rat)	426

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