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Ligand

NameUPCMLD08ADHK001121
Molecular formulaC26H26F4N2O2
IUPAC name1-benzoyl-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-methyl-1-azaspiro[4.5]dec-3-ene-2-carboxamide
Molecular weight474.5
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.4
SynonymsHMS2205I16
4-benzoyl-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-3-methyl-4-azaspiro[4.5]dec-1-ene-3-carboxamide
MLS003180920
CHEMBL1334016
SMR000389117
[ Show all ]
Inchi KeyABSNQHHXHGUWOE-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26F4N2O2/c1-24(23(34)31-17-18-14-20(26(28,29)30)16-21(27)15-18)12-13-25(10-6-3-7-11-25)32(24)22(33)19-8-4-2-5-9-19/h2,4-5,8-9,12-16H,3,6-7,10-11,17H2,1H3,(H,31,34)
PubChem CID5459723
ChEMBLCHEMBL1334016
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463093Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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