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Ligand

NameCHEMBL396748
Molecular formulaC24H27F3N2O3
IUPAC name2-[4-methoxy-3-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]-7-(trifluoromethyl)-3H-isoindol-1-one
Molecular weight448.486
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.7
SynonymsSCHEMBL5476560
Inchi KeyAPEDIPJHWNTQGP-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H27F3N2O3/c1-16-8-10-28(11-9-16)12-13-32-21-14-18(6-7-20(21)31-2)29-15-17-4-3-5-19(24(25,26)27)22(17)23(29)30/h3-7,14,16H,8-13,15H2,1-2H3
PubChem CID17989823
ChEMBLCHEMBL396748
IUPHARN/A
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
108885-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
108895-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
108875-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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