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Ligand

NameCHEMBL3596478
Molecular formulaC28H31F3N2O
IUPAC nameN,N-dimethyl-4-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]aniline
Molecular weight468.564
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP6.0
SynonymsBDBM50106390
Inchi KeyAYHSCBGJZCCERQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H31F3N2O/c1-33(2)26-10-8-22(9-11-26)23-16-21(17-25(18-23)28(29,30)31)19-34-20-27(12-14-32-15-13-27)24-6-4-3-5-7-24/h3-11,16-18,32H,12-15,19-20H2,1-2H3
PubChem CID122182824
ChEMBLCHEMBL3596478
IUPHARN/A
BindingDB50106390
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
465021Substance-P receptorQ5DUB1TACR1Meriones unguiculatus (Mongolian jird)407
557773Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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