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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	CHEMBL2113609
Molecular formula	C17H25N5O4
IUPAC name	(2R,3R,4R,5R)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)-3-methyloxolane-3,4-diol
Molecular weight	363.418
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	0.8
Synonyms	Adenosine, N-cyclohexyl-2'-C-methyl- 9-(2'-C-methyl-beta-D-ribofuranosyl)-6-(cyclohexylamino)purine BDBM50410289 SCHEMBL6378397 AACDCSBTWQKCLH-MCPWVCTESA-N 622379-72-0 [ Show all ]
Inchi Key	AACDCSBTWQKCLH-MCPWVCTESA-N
Inchi ID	InChI=1S/C17H25N5O4/c1-17(25)13(24)11(7-23)26-16(17)22-9-20-12-14(18-8-19-15(12)22)21-10-5-3-2-4-6-10/h8-11,13,16,23-25H,2-7H2,1H3,(H,18,19,21)/t11-,13-,16-,17-/m1/s1
PubChem CID	10338742
ChEMBL	CHEMBL2113609
IUPHAR	N/A
BindingDB	50410289
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
51	Adenosine receptor A1	P28190	ADORA1	Bos taurus (Bovine)	326
50	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
441670	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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