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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	CHEMBL335853
Molecular formula	C25H24N4S
IUPAC name	2-[4-(2,2-diphenylethanethioyl)piperazin-1-yl]-2-pyridin-3-ylacetonitrile
Molecular weight	412.555
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.8
Synonyms	BDBM50003548 [4-(2,2-Diphenyl-thioacetyl)-piperazin-1-yl]-pyridin-3-yl-acetonitrile; hydrate 2-[4-(1-Thioxo-2,2-diphenylethyl)-1-piperazinyl]-2-(3-pyridinyl)acetonitrile
Inchi Key	DXCWINALYPMAAL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H24N4S/c26-18-23(22-12-7-13-27-19-22)28-14-16-29(17-15-28)25(30)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,19,23-24H,14-17H2
PubChem CID	10454370
ChEMBL	CHEMBL335853
IUPHAR	N/A
BindingDB	50003548
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
71190	Platelet-activating factor receptor	P21556	PTAFR	Cavia porcellus (Guinea pig)	342
71191	Platelet-activating factor receptor	P46002	Ptafr	Rattus norvegicus (Rat)	341
71192	Platelet-activating factor receptor	Q62035	Ptafr	Mus musculus (Mouse)	341

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