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Ligand

NameCHEMBL2069576
Molecular formulaC25H24N4O2S
IUPAC name(2S)-N-(2-methoxy-5-pyridin-4-ylphenyl)-3-phenyl-2-(1,3-thiazol-4-ylmethylamino)propanamide
Molecular weight444.553
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50390596
Inchi KeyJPBHIEUPWCNYJD-QHCPKHFHSA-N
Inchi IDInChI=1S/C25H24N4O2S/c1-31-24-8-7-20(19-9-11-26-12-10-19)14-22(24)29-25(30)23(13-18-5-3-2-4-6-18)27-15-21-16-32-17-28-21/h2-12,14,16-17,23,27H,13,15H2,1H3,(H,29,30)/t23-/m0/s1
PubChem CID70697110
ChEMBLCHEMBL2069576
IUPHARN/A
BindingDB50390596
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
156413Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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