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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	CHEMBL3596495
Molecular formula	C30H29F3N2O
IUPAC name	4-[3-[(1-cyclopropyl-4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile
Molecular weight	490.57
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	6.6
Synonyms	JJSFBTVUNKEJKM-UHFFFAOYSA-N 3'-(((1-Cyclopropyl-4-phenylpiperidin-4-yl)methoxy)methyl)-5'-(trifluoromethyl)biphenyl-4-carbonitrile SCHEMBL3597292 BDBM50106368
Inchi Key	JJSFBTVUNKEJKM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C30H29F3N2O/c31-30(32,33)27-17-23(16-25(18-27)24-8-6-22(19-34)7-9-24)20-36-21-29(26-4-2-1-3-5-26)12-14-35(15-13-29)28-10-11-28/h1-9,16-18,28H,10-15,20-21H2
PubChem CID	58993542
ChEMBL	CHEMBL3596495
IUPHAR	N/A
BindingDB	50106368
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
481739	Substance-P receptor	Q5DUB1	TACR1	Meriones unguiculatus (Mongolian jird)	407
562085	Substance-P receptor	P14600	Tacr1	Rattus norvegicus (Rat)	407

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