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Ligand

NameCHEMBL338696
Molecular formulaC22H25FN2O
IUPAC name1-(4-fluorophenyl)-4-(5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-2-yl)butan-1-ol
Molecular weight352.453
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.6
SynonymsBDBM50132094
1-(4-Fluoro-phenyl)-4-(5-methyl-1,3,4,5-tetrahydro-pyrido[4,3-b]indol-2-yl)-butan-1-ol
Inchi KeyARHHDTLXUBIQJK-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25FN2O/c1-24-20-6-3-2-5-18(20)19-15-25(14-12-21(19)24)13-4-7-22(26)16-8-10-17(23)11-9-16/h2-3,5-6,8-11,22,26H,4,7,12-15H2,1H3
PubChem CID44351077
ChEMBLCHEMBL338696
IUPHARN/A
BindingDB50132094
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
124615-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
124585-hydroxytryptamine receptor 2CP08909Htr2cRattus norvegicus (Rat)460
124595-hydroxytryptamine receptor 5AP30966Htr5aMus musculus (Mouse)357
124605-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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