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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL334466
Molecular formulaC25H28FNO5
IUPAC name1-(1-benzylpiperidin-4-yl)-3-(4-fluorophenyl)propan-2-one;(Z)-but-2-enedioic acid
Molecular weight441.499
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogPNone
SynonymsN/A
Inchi KeyAKDUBQMSZOFGBK-BTJKTKAUSA-N
Inchi IDInChI=1S/C21H24FNO.C4H4O4/c22-20-8-6-17(7-9-20)14-21(24)15-18-10-12-23(13-11-18)16-19-4-2-1-3-5-19;5-3(6)1-2-4(7)8/h1-9,18H,10-16H2;1-2H,(H,5,6)(H,7,8)/b;2-1-
PubChem CID10048934
ChEMBLCHEMBL334466
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7460D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444

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