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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	CHEMBL212633
Molecular formula	C29H20N6O4
IUPAC name	N-(6-nitro-1-oxo-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-2,2-diphenylacetamide
Molecular weight	516.517
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.0
Synonyms	N-(6-nitro-1-oxo-2-phenyl-1,2-dihydro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-2,2-diphenylacetamide BDBM50189806
Inchi Key	CWZZNUIDUXUNFR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H20N6O4/c36-28(24(19-11-4-1-5-12-19)20-13-6-2-7-14-20)31-26-27-32-34(21-15-8-3-9-16-21)29(37)33(27)22-17-10-18-23(35(38)39)25(22)30-26/h1-18,24H,(H,30,31,36)
PubChem CID	11706243
ChEMBL	CHEMBL212633
IUPHAR	N/A
BindingDB	50189806
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
52629	Adenosine receptor A1	P28190	ADORA1	Bos taurus (Bovine)	326
52630	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
52627	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
52628	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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