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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	CHEMBL1784235
Molecular formula	C24H24F3N5O3
IUPAC name	ethyl 5-cyano-6-[4-[[(1R,2S)-2-phenylcyclopropyl]carbamoyl]piperazin-1-yl]-2-(trifluoromethyl)pyridine-3-carboxylate
Molecular weight	487.483
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	3.2
Synonyms	BDBM50345281 Ethyl 5-cyano-6-(4-((1R,2S)-2-phenylcyclopropylcarbamoyl)piperazin-1-yl)-2-(trifluoromethyl)nicotinate
Inchi Key	BFBMMUGOJSXXME-PKOBYXMFSA-N
Inchi ID	InChI=1S/C24H24F3N5O3/c1-2-35-22(33)18-12-16(14-28)21(30-20(18)24(25,26)27)31-8-10-32(11-9-31)23(34)29-19-13-17(19)15-6-4-3-5-7-15/h3-7,12,17,19H,2,8-11,13H2,1H3,(H,29,34)/t17-,19+/m0/s1
PubChem CID	54581027
ChEMBL	CHEMBL1784235
IUPHAR	N/A
BindingDB	50345281
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
22141	P2Y purinoceptor 12	Q9H244	P2RY12	Homo sapiens (Human)	342

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