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Ligand

NameCHEMBL600419
Molecular formulaC21H15FN2O3
IUPAC name5-fluoro-4-oxo-1-[(4-pyrrol-1-ylphenyl)methyl]quinoline-3-carboxylic acid
Molecular weight362.36
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.0
SynonymsN/A
Inchi KeyAKWUSVGOXKETFG-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H15FN2O3/c22-17-4-3-5-18-19(17)20(25)16(21(26)27)13-24(18)12-14-6-8-15(9-7-14)23-10-1-2-11-23/h1-11,13H,12H2,(H,26,27)
PubChem CID46232952
ChEMBLCHEMBL600419
IUPHARN/A
BindingDBN/A
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
7977Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460

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