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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	CHEMBL1773290
Molecular formula	C22H27N5O5S
IUPAC name	tert-butyl 4-[9-(4-methylsulfonylphenyl)purin-6-yl]oxypiperidine-1-carboxylate
Molecular weight	473.548
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	2.7
Synonyms	4-[9-(4-Methanesulfonyl-phenyl)9H-purin-6-yloxy]-piperidine-1-carboxylic acid tert-butyl ester BTYRTNRWQFWQNI-UHFFFAOYSA-N 143093-EP2292620A2 SCHEMBL392033 143093-EP2287165A2 4-[9-(4-Methanesulfonyl-phenyl)-9H-purin-6-yloxy]-piperidine-1-carboxylic acid tert-butyl ester tert-butyl 4-(9-(4-(methylsulfonyl)phenyl)-9H-purin-6-yloxy)piperidine-1-carboxylate BDBM50343461 143093-EP2287166A2 [ Show all ]
Inchi Key	BTYRTNRWQFWQNI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H27N5O5S/c1-22(2,3)32-21(28)26-11-9-16(10-12-26)31-20-18-19(23-13-24-20)27(14-25-18)15-5-7-17(8-6-15)33(4,29)30/h5-8,13-14,16H,9-12H2,1-4H3
PubChem CID	53630423
ChEMBL	CHEMBL1773290
IUPHAR	N/A
BindingDB	50343461
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
32815	Glucose-dependent insulinotropic receptor	Q8TDV5	GPR119	Homo sapiens (Human)	335
32816	Glucose-dependent insulinotropic receptor	Q7TQN8	Gpr119	Rattus norvegicus (Rat)	468

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