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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	MLS000078748
Molecular formula	C20H22N4O3
IUPAC name	2-methoxyethyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyanoacetate
Molecular weight	366.421
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	2.6
Synonyms	2-methoxyethyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyano-ethanoate SMR000041510 2-[3-[bis(prop-2-enyl)amino]-2-quinoxalinyl]-2-cyanoacetic acid 2-methoxyethyl ester HMS2303I07 AKOS005474936 MLS002582161 2-methoxyethyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyanoacetate CHEMBL1559433 STK546425 496773-80-9 MCULE-4551906770 2-cyano-2-[3-(diallylamino)quinoxalin-2-yl]acetic acid 2-methoxyethyl ester BDBM74581 MolPort-002-578-662 2-methoxyethyl cyano[3-(diprop-2-en-1-ylamino)quinoxalin-2-yl]acetate cid_660819 AC1LD3UY [ Show all ]
Inchi Key	ACVMJYMVYNOSNH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H22N4O3/c1-4-10-24(11-5-2)19-18(15(14-21)20(25)27-13-12-26-3)22-16-8-6-7-9-17(16)23-19/h4-9,15H,1-2,10-13H2,3H3
PubChem CID	660819
ChEMBL	CHEMBL1559433
IUPHAR	N/A
BindingDB	N/A
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
1975	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
1974	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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