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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	CHEMBL3596487
Molecular formula	C27H21F7N2O
IUPAC name	2,3,5,6-tetrafluoro-4-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile
Molecular weight	522.467
Hydrogen bond acceptor	10
Hydrogen bond donor	1
XlogP	6.0
Synonyms	BDBM50106360 SCHEMBL3598666
Inchi Key	UIHAXJYWFWQPHO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H21F7N2O/c28-22-20(13-35)23(29)25(31)21(24(22)30)17-10-16(11-19(12-17)27(32,33)34)14-37-15-26(6-8-36-9-7-26)18-4-2-1-3-5-18/h1-5,10-12,36H,6-9,14-15H2
PubChem CID	58993634
ChEMBL	CHEMBL3596487
IUPHAR	N/A
BindingDB	50106360
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
504619	Substance-P receptor	Q5DUB1	TACR1	Meriones unguiculatus (Mongolian jird)	407
567842	Substance-P receptor	P14600	Tacr1	Rattus norvegicus (Rat)	407

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