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Ligand

NameMLS000699691
Molecular formulaC22H21ClN2O5
IUPAC name5-[(2-chlorophenoxy)methyl]-N-[(E)-(2,4-dimethoxy-3-methylphenyl)methylideneamino]furan-2-carboxamide
Molecular weight428.869
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.7
SynonymsSMR000227699
5-[(2-chlorophenoxy)methyl]-N'-(2,4-dimethoxy-3-methylbenzylidene)-2-furohydrazide
5-[(2-chlorophenoxy)methyl]-N-[(E)-(2,4-dimethoxy-3-methylphenyl)methylideneamino]furan-2-carboxamide
AC1OB7KD
CHEMBL1994163
[ Show all ]
Inchi KeyALSZPRQIWXWJGV-WYMPLXKRSA-N
Inchi IDInChI=1S/C22H21ClN2O5/c1-14-18(27-2)10-8-15(21(14)28-3)12-24-25-22(26)20-11-9-16(30-20)13-29-19-7-5-4-6-17(19)23/h4-12H,13H2,1-3H3,(H,25,26)/b24-12+
PubChem CID6874399
ChEMBLCHEMBL1994163
IUPHARN/A
BindingDB88459
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8557Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
8558Melanocortin receptor 4P32245MC4RHomo sapiens (Human)332

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