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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	CHEMBL109474
Molecular formula	C29H44N2O6
IUPAC name	(2S,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-[2-(oxan-4-yl)ethyl]pyrrolidine-3-carboxylic acid
Molecular weight	516.679
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.3
Synonyms	BDBM50066390 (2S,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-dibutylcarbamoylmethyl-2-[2-(tetrahydro-pyran-4-yl)-ethyl]-pyrrolidine-3-carboxylic acid
Inchi Key	AOYNZEMYNLSHBX-FMGHJNRGSA-N
Inchi ID	InChI=1S/C29H44N2O6/c1-3-5-13-30(14-6-4-2)27(32)19-31-18-23(22-8-10-25-26(17-22)37-20-36-25)28(29(33)34)24(31)9-7-21-11-15-35-16-12-21/h8,10,17,21,23-24,28H,3-7,9,11-16,18-20H2,1-2H3,(H,33,34)/t23-,24+,28-/m1/s1
PubChem CID	10791988
ChEMBL	CHEMBL109474
IUPHAR	N/A
BindingDB	50066390
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
10754	Endothelin receptor type B	P24530	EDNRB	Homo sapiens (Human)	442
10755	Endothelin-1 receptor	P26684	Ednra	Rattus norvegicus (Rat)	426

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