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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	CHEMBL2070882
Molecular formula	C20H25N9O2
IUPAC name	1-[4-(furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]-3-(1-propylpiperidin-4-yl)urea
Molecular weight	423.481
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	1.7
Synonyms	BDBM50389899
Inchi Key	AOPPYLPJMVDJIR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H25N9O2/c1-3-8-28-9-6-13(7-10-28)21-20(30)24-19-23-16-14(12-27(2)25-16)18-22-17(26-29(18)19)15-5-4-11-31-15/h4-5,11-13H,3,6-10H2,1-2H3,(H2,21,23,24,25,30)
PubChem CID	60155714
ChEMBL	CHEMBL2070882
IUPHAR	N/A
BindingDB	50389899
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
10495	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
10496	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
10498	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
10497	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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