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Ligand

NameCHEMBL3356856
Molecular formulaC24H26FN3O5
IUPAC name(2S)-2-[[5-(2,6-dimethoxyphenyl)-1-(4-fluorophenyl)pyrazole-3-carbonyl]amino]-4-methylpentanoic acid
Molecular weight455.486
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50183346
SCHEMBL17326247
Inchi KeyQFPJNQKPPAKGRP-SFHVURJKSA-N
Inchi IDInChI=1S/C24H26FN3O5/c1-14(2)12-18(24(30)31)26-23(29)17-13-19(22-20(32-3)6-5-7-21(22)33-4)28(27-17)16-10-8-15(25)9-11-16/h5-11,13-14,18H,12H2,1-4H3,(H,26,29)(H,30,31)/t18-/m0/s1
PubChem CID118568560
ChEMBLCHEMBL3356856
IUPHARN/A
BindingDB50183346
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
529401Apelin receptorP35414APLNRHomo sapiens (Human)380
452644Neurotensin receptor type 2Q63384Ntsr2Rattus norvegicus (Rat)416

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