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Ligand

NameMLS001177016
Molecular formulaC15H10ClNO4
IUPAC name(E)-3-(3-chloro-4,5-dihydroxyphenyl)-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile
Molecular weight303.698
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.0
SynonymsREGID_for_CID_9366753
CHEMBL1308904
SMR000595167
AKOS001283213
Inchi KeyABTYXTTVFMYFEZ-ONNFQVAWSA-N
Inchi IDInChI=1S/C15H10ClNO4/c1-8-11(2-3-21-8)14(19)10(7-17)4-9-5-12(16)15(20)13(18)6-9/h2-6,18,20H,1H3/b10-4+
PubChem CID9366753
ChEMBLCHEMBL1308904
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
463102Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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