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Ligand

NameCHEMBL3393789
Molecular formulaC31H35ClFNO3
IUPAC name[(1R)-4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butyl] 4-phenylbutanoate
Molecular weight524.073
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.5
SynonymsBDBM50059789
Inchi KeyBYFXZIUNDKEGTH-GDLZYMKVSA-N
Inchi IDInChI=1S/C31H35ClFNO3/c32-27-15-13-26(14-16-27)31(36)19-22-34(23-20-31)21-5-9-29(25-11-17-28(33)18-12-25)37-30(35)10-4-8-24-6-2-1-3-7-24/h1-3,6-7,11-18,29,36H,4-5,8-10,19-23H2/t29-/m1/s1
PubChem CID118725675
ChEMBLCHEMBL3393789
IUPHARN/A
BindingDB50059789
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
443104D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
443105D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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