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Ligand

NameCHEMBL593435
Molecular formulaC15H16ClN3O
IUPAC name(2S)-2-(4-chlorophenyl)-3-methyl-N-pyridazin-3-ylbutanamide
Molecular weight289.763
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.9
SynonymsBDBM50305954
(S)-2-(4-chlorophenyl)-3-methyl-N-(pyridazin-3-yl)butanamide
Inchi KeyDYKQXHLDYNKKKR-AWEZNQCLSA-N
Inchi IDInChI=1S/C15H16ClN3O/c1-10(2)14(11-5-7-12(16)8-6-11)15(20)18-13-4-3-9-17-19-13/h3-10,14H,1-2H3,(H,18,19,20)/t14-/m0/s1
PubChem CID46226161
ChEMBLCHEMBL593435
IUPHARN/A
BindingDB50305954
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
72046Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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