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Ligand

NameCHEMBL1836792
Molecular formulaC24H24F4N2O
IUPAC name5-fluoro-3-[4-[4-[3-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]butyl]-1,3-dihydroindol-2-one
Molecular weight432.463
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.8
SynonymsBDBM50354498
SCHEMBL5176507
Inchi KeyAFFLRZAJRVFCHF-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24F4N2O/c25-19-7-8-22-21(15-19)20(23(31)29-22)6-1-2-11-30-12-9-16(10-13-30)17-4-3-5-18(14-17)24(26,27)28/h3-5,7-9,14-15,20H,1-2,6,10-13H2,(H,29,31)
PubChem CID11532105
ChEMBLCHEMBL1836792
IUPHARN/A
BindingDB50354498
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
41295-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
41285-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479

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