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Ligand

NamePENFLURIDOL
Molecular formulaC28H27ClF5NO
IUPAC name1-[4,4-bis(4-fluorophenyl)butyl]-4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol
Molecular weight523.972
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP7.3
SynonymsPENFLURIDOL1-[4,4-Bis-(4-fluoro-phenyl)-butyl]-4-(4-chloro-3-trifluoromethyl-phenyl)-piperidin-4-ol
4-Piperidinol, 4-(4-chloro-.alpha.,.alpha.,.alpha.-trifluoro-m-tolyl)-1-(4,4-bis(p-fluorophenyl)butyl)-
R16341
AB0011815
SMR003500704
[ Show all ]
Inchi KeyMDLAAYDRRZXJIF-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H27ClF5NO/c29-26-12-7-21(18-25(26)28(32,33)34)27(36)13-16-35(17-14-27)15-1-2-24(19-3-8-22(30)9-4-19)20-5-10-23(31)11-6-20/h3-12,18,24,36H,1-2,13-17H2
PubChem CID33630
ChEMBLN/A
IUPHARN/A
BindingDB50026066
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5562855-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
2027725-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
2027715-hydroxytryptamine receptor 6P31388Htr6Rattus norvegicus (Rat)436
5562875-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
202770D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
556286D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444
202773D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387

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