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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	CHEMBL1077816
Molecular formula	C32H27F3N4O3
IUPAC name	N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(pyridin-3-ylmethyl)-2-(3,4,5-trifluorophenyl)acetamide
Molecular weight	572.588
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	5.0
Synonyms	(R)-N-(1-(3-(4-ethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)ethyl)-N-(pyridin-3-ylmethyl)-2-(3,4,5-trifluorophenyl)acetamide BDBM50310498
Inchi Key	BYEWCQUFFQUXQI-HXUWFJFHSA-N
Inchi ID	InChI=1S/C32H27F3N4O3/c1-3-42-24-12-10-23(11-13-24)39-31(37-28-9-5-4-8-25(28)32(39)41)20(2)38(19-21-7-6-14-36-18-21)29(40)17-22-15-26(33)30(35)27(34)16-22/h4-16,18,20H,3,17,19H2,1-2H3/t20-/m1/s1
PubChem CID	46883296
ChEMBL	CHEMBL1077816
IUPHAR	N/A
BindingDB	50310498
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
35721	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368

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