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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	CHEMBL9283
Molecular formula	C31H34N2O6
IUPAC name	(2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-1-[2-(N-butylanilino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid
Molecular weight	530.621
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.7
Synonyms	(2S,3S,4R)-4-Benzo[1,3]dioxol-5-yl-1-[(butyl-phenyl-carbamoyl)-methyl]-2-(4-methoxy-phenyl)-pyrrolidine-3-carboxylic acid BDBM50050982
Inchi Key	DFQYXTXEDKPKTC-JPHFWNGBSA-N
Inchi ID	InChI=1S/C31H34N2O6/c1-3-4-16-33(23-8-6-5-7-9-23)28(34)19-32-18-25(22-12-15-26-27(17-22)39-20-38-26)29(31(35)36)30(32)21-10-13-24(37-2)14-11-21/h5-15,17,25,29-30H,3-4,16,18-20H2,1-2H3,(H,35,36)/t25-,29-,30+/m0/s1
PubChem CID	10792319
ChEMBL	CHEMBL9283
IUPHAR	N/A
BindingDB	50050982
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
58814	Endothelin receptor type B	P35463	EDNRB	Sus scrofa (Pig)	443
58815	Endothelin-1 receptor	P26684	Ednra	Rattus norvegicus (Rat)	426

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