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Ligand

NameN-[3,5-dimethyl-1-(2,3,4,5,6-pentafluorobenzyl)-1H-pyrazol-4-yl]-4-nitro-1-methyl-1H-pyrazole-5-carboxamide
Molecular formulaC17H13F5N6O3
IUPAC nameN-[3,5-dimethyl-1-[(2,3,4,5,6-pentafluorophenyl)methyl]pyrazol-4-yl]-2-methyl-4-nitropyrazole-3-carboxamide
Molecular weight444.322
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP2.4
SynonymsAC1LX9IO
AK-968/41924675
AKOS003986613
CHEMBL1332069
HMS2445H03
[ Show all ]
Inchi KeyAGKVLSWEBIASFU-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H13F5N6O3/c1-6-15(24-17(29)16-9(28(30)31)4-23-26(16)3)7(2)27(25-6)5-8-10(18)12(20)14(22)13(21)11(8)19/h4H,5H2,1-3H3,(H,24,29)
PubChem CID1768056
ChEMBLCHEMBL1332069
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
463488Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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