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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	CHEMBL11173
Molecular formula	C23H31N5O6S
IUPAC name	ethyl 4-[[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenyl]sulfonylamino]butanoate
Molecular weight	505.59
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	3.8
Synonyms	BDBM50020979 4-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-benzenesulfonylamino]-butyric acid ethyl ester
Inchi Key	BCNIMWNZIJLNRF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H31N5O6S/c1-4-14-27-21-19(22(30)28(15-5-2)23(27)31)25-20(26-21)16-9-11-17(12-10-16)35(32,33)24-13-7-8-18(29)34-6-3/h9-12,24H,4-8,13-15H2,1-3H3,(H,25,26)
PubChem CID	13525081
ChEMBL	CHEMBL11173
IUPHAR	N/A
BindingDB	50020979
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
20334	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
20335	Adenosine receptor A1	P28190	ADORA1	Bos taurus (Bovine)	326

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