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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	CHEMBL3421903
Molecular formula	C66H74Cl4N8O12
IUPAC name	3-[2,5-dichloro-4-[3-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)pyridin-4-yl]oxyphenyl]-N-[2-[2-[2-[2-[2-[2-[2-[3-[2,5-dichloro-4-[3-(4-cyclopropyl-2,3-dihydroquinoxaline-1-carbonyl)pyridin-4-yl]oxyphenyl]propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
Molecular weight	1313.16
Hydrogen bond acceptor	16
Hydrogen bond donor	2
XlogP	8.1
Synonyms	J3.552.506H N,N'-[Ethylenebis(oxyethyleneoxyethyleneoxyethylene)]bis[3-[2,5-dichloro-4-[[3-[[4-cyclopropyl-3,4-dihydroquinoxaline-1(2H)-yl]carbonyl]-4-pyridinyl]oxy]phenyl]propanamide] BDBM50081113
Inchi Key	DUCLZGWXZLMMTP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C66H74Cl4N8O12/c67-51-41-61(89-59-17-19-71-43-49(59)65(81)77-25-23-75(47-11-12-47)55-5-1-3-7-57(55)77)53(69)39-45(51)9-15-63(79)73-21-27-83-29-31-85-33-35-87-37-38-88-36-34-86-32-30-84-28-22-74-64(80)16-10-46-40-54(70)62(42-52(46)68)90-60-18-20-72-44-50(60)66(82)78-26-24-76(48-13-14-48)56-6-2-4-8-58(56)78/h1-8,17-20,39-44,47-48H,9-16,21-38H2,(H,73,79)(H,74,80)
PubChem CID	118735267
ChEMBL	CHEMBL3421903
IUPHAR	N/A
BindingDB	50081113
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
444396	G-protein coupled bile acid receptor 1	Q8TDU6	GPBAR1	Homo sapiens (Human)	330
444397	G-protein coupled bile acid receptor 1	Q80SS6	Gpbar1	Mus musculus (Mouse)	329

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