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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	CHEMBL202722
Molecular formula	C25H24N6O5
IUPAC name	(2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-[(4-phenylbenzoyl)amino]purin-9-yl]oxolane-2-carboxamide
Molecular weight	488.504
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	1.9
Synonyms	BDBM50179025 N-[(1,1'-Biphenyl-4-yl)carbonyl]-5'-(ethylamino)-5'-oxo-5'-deoxyadenosine (2S,3S,4R,5R)-5-{6-[(Biphenyl-4-carbonyl)-amino]-purin-9-yl}-3,4-dihydroxy-tetrahydro-furan-2-carboxylicacid ethylamide
Inchi Key	FBMOMQNCWCOOAE-PBQROFAYSA-N
Inchi ID	InChI=1S/C25H24N6O5/c1-2-26-24(35)20-18(32)19(33)25(36-20)31-13-29-17-21(27-12-28-22(17)31)30-23(34)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-13,18-20,25,32-33H,2H2,1H3,(H,26,35)(H,27,28,30,34)/t18-,19+,20-,25+/m0/s1
PubChem CID	10529007
ChEMBL	CHEMBL202722
IUPHAR	N/A
BindingDB	50179025
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
74347	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
74346	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
74348	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320

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