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Ligand

NameSCHEMBL3591663
Molecular formulaC25H25F3N2O
IUPAC name2-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]pyridine
Molecular weight426.483
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
SynonymsCHEMBL3596200
Inchi KeyMKLPQTSLHXOEGQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25F3N2O/c26-25(27,28)22-15-19(14-20(16-22)23-8-4-5-11-30-23)17-31-18-24(9-12-29-13-10-24)21-6-2-1-3-7-21/h1-8,11,14-16,29H,9-10,12-13,17-18H2
PubChem CID58993510
ChEMBLCHEMBL3596200
IUPHARN/A
BindingDB50108643
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
488661Substance-P receptorQ5DUB1TACR1Meriones unguiculatus (Mongolian jird)407
563853Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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