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Ligand

NameMLS002159455
Molecular formulaC21H17ClF3N3O3
IUPAC nameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-[methyl-(2-quinolin-8-yloxyacetyl)amino]acetamide
Molecular weight451.83
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.1
SynonymsCHEMBL2135739
MolPort-004-150-507
ZINC13102705
AKOS033961356
MCULE-2800727369
[ Show all ]
Inchi KeyAETGNWWYNMYYKY-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H17ClF3N3O3/c1-28(11-18(29)27-14-7-8-16(22)15(10-14)21(23,24)25)19(30)12-31-17-6-2-4-13-5-3-9-26-20(13)17/h2-10H,11-12H2,1H3,(H,27,29)
PubChem CID16287564
ChEMBLCHEMBL2135739
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463345Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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