CHEBI:149793 - 4-[(Z)-[1-(4-Fluorophenyl)-5-oxo-3-phenylpyrazol-4-ylidene]methyl]benzoic acid

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ChEBI Name 4-[(Z)-[1-(4-Fluorophenyl)-5-oxo-3-phenylpyrazol-4-ylidene]methyl]benzoic acid
ChEBI ID CHEBI:149793
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H15FN2O3
Net Charge 0
Average Mass 386.382
Monoisotopic Mass 386.10667
InChI InChI=1S/C23H15FN2O3/c24-18-10-12-19(13-11-18)26-22(27)20(21(25-26)16-4-2-1-3-5-16)14-15-6-8-17(9-7-15)23(28)29/h1-14H,(H,28,29)/b20-14-
InChIKey ORQDYVINJXCMJR-ZHZULCJRSA-N
SMILES N1(C=2C=CC(=CC2)F)N=C(C=3C=CC=CC3)/C(=C/C4=CC=C(C=C4)C(=O)O)/C1=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
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ChEBI Ontology
Outgoing 4-[(Z)-[1-(4-Fluorophenyl)-5-oxo-3-phenylpyrazol-4-ylidene]methyl]benzoic acid (CHEBI:149793) has role anticoronaviral agent (CHEBI:149553)
4-[(Z)-[1-(4-Fluorophenyl)-5-oxo-3-phenylpyrazol-4-ylidene]methyl]benzoic acid (CHEBI:149793) is a benzoic acids (CHEBI:22723)
General Comment
2020-05-22 anti-coronaviral activity data of this compound obtained from ChEMBL