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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	CHEMBL2113547
Molecular formula	C17H24ClN5O4
IUPAC name	(2R,3R,4S,5R)-2-[2-chloro-6-(cyclopentylamino)purin-9-yl]-5-(ethoxymethyl)oxolane-3,4-diol
Molecular weight	397.86
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	1.4
Synonyms	AWTMTQOYFLGHJN-XNIJJKJLSA-N N-Cyclopentyl-2-chloro-5'-O-ethyladenosine N6-cyclopentyl-2-Chloro-5'-O-ethyladenosine
Inchi Key	AWTMTQOYFLGHJN-XNIJJKJLSA-N
Inchi ID	InChI=1S/C17H24ClN5O4/c1-2-26-7-10-12(24)13(25)16(27-10)23-8-19-11-14(20-9-5-3-4-6-9)21-17(18)22-15(11)23/h8-10,12-13,16,24-25H,2-7H2,1H3,(H,20,21,22)/t10-,12-,13-,16-/m1/s1
PubChem CID	11003842
ChEMBL	CHEMBL2113547
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
16355	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
16357	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
16356	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
442298	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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