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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	CHEMBL80161
Molecular formula	C27H28N8O2S
IUPAC name	ethyl 2-[[5-methyl-7-propyl-8-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]sulfanyl]acetate
Molecular weight	528.635
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	5.6
Synonyms	BDBM50039363 LS-12555 {5-Methyl-7-propyl-8-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-[1,2,4]triazolo[1,5-c]pyrimidin-2-ylsulfanyl}-acetic acid ethyl ester
Inchi Key	BEKNQDBPXBGALH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H28N8O2S/c1-4-8-23-22(26-29-27(32-35(26)17(3)28-23)38-16-24(36)37-5-2)15-18-11-13-19(14-12-18)20-9-6-7-10-21(20)25-30-33-34-31-25/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H,30,31,33,34)
PubChem CID	10369660
ChEMBL	CHEMBL80161
IUPHAR	N/A
BindingDB	50039363
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
21647	Type-1B angiotensin II receptor	P29089	Agtr1b	Rattus norvegicus (Rat)	359

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