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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	CHEMBL3144602
Molecular formula	C20H15F3N2O5
IUPAC name	2,4-bis(1,3-benzodioxol-5-ylmethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one
Molecular weight	420.344
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	3.9
Synonyms	2,4-Bis-benzo[1,3]dioxol-5-ylmethyl-5-trifluoromethyl-2H-pyrazol-3-ol CHEMBL29956 1,4-Bis(1,3-benzodioxole-5-ylmethyl)-3-(trifluoromethyl)-1H-pyrazole-5-ol BDBM50089727
Inchi Key	GSYUSCVEJUNUJA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H15F3N2O5/c21-20(22,23)18-13(5-11-1-3-14-16(6-11)29-9-27-14)19(26)25(24-18)8-12-2-4-15-17(7-12)30-10-28-15/h1-4,6-7,24H,5,8-10H2
PubChem CID	15340616
ChEMBL	CHEMBL3144602
IUPHAR	N/A
BindingDB	50089727
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
104593	Endothelin receptor type B	P21451	Ednrb	Rattus norvegicus (Rat)	442
104592	Endothelin-1 receptor	P26684	Ednra	Rattus norvegicus (Rat)	426

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