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Ligand

NameCHEMBL3318845
Molecular formulaC23H25ClFNO3
IUPAC name[4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] acetate
Molecular weight417.905
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.8
SynonymsBDBM50053390
DQMKFVKNNDMGTA-UHFFFAOYSA-N
4-(4-Acetoxy-4-(4-chlorophenyl)-1-piperidinyl)-1-(4-fluorophenyl)-1-butanone
SCHEMBL8986083
Inchi KeyDQMKFVKNNDMGTA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25ClFNO3/c1-17(27)29-23(19-6-8-20(24)9-7-19)12-15-26(16-13-23)14-2-3-22(28)18-4-10-21(25)11-5-18/h4-11H,2-3,12-16H2,1H3
PubChem CID23364995
ChEMBLCHEMBL3318845
IUPHARN/A
BindingDB50053390
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
444305D(1A) dopamine receptorP50130DRD1Sus scrofa (Pig)446
444302D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
444304D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
444303D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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