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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	CHEMBL54505
Molecular formula	C24H30N6O3
IUPAC name	N-[(2R,3R,4R,5R)-5-[6-(cyclopentylamino)purin-9-yl]-4-hydroxy-2-methyloxolan-3-yl]-3,4-dimethylbenzamide
Molecular weight	450.543
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	2.9
Synonyms	BDBM50112199 N-[5-(6-Cyclopentylamino-purin-9-yl)-4-hydroxy-2-methyl-tetrahydro-furan-3-yl]-3,4-dimethyl-benzamide
Inchi Key	ANEWOVOUCFPRTN-XGFUBRKBSA-N
Inchi ID	InChI=1S/C24H30N6O3/c1-13-8-9-16(10-14(13)2)23(32)29-18-15(3)33-24(20(18)31)30-12-27-19-21(25-11-26-22(19)30)28-17-6-4-5-7-17/h8-12,15,17-18,20,24,31H,4-7H2,1-3H3,(H,29,32)(H,25,26,28)/t15-,18+,20-,24-/m1/s1
PubChem CID	11080871
ChEMBL	CHEMBL54505
IUPHAR	N/A
BindingDB	50112199
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
9503	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326

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