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Compound Detail

CHEMBL324455

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CC(=O)Nc1c(O)cc(C(=O)O)cc1[N+](=O)[O-]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL324455
Phase Preclinical
Structure Type MOL
InChI Key JIDRTCHFBHJIDG-UHFFFAOYSA-N
0
Targets
7
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

240.2
MW (Da)
0.96
ALogP
5
HBA
3
HBD
129.8
PSA (Ų)
0.41
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H8N2O6
MW 240.17
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.70

Activity Summary

IC50 7 meas.

Literature References

PubMed DOI Target Context # Activities
7650674 10.1021/jm00017a005 Influenza A virus 2
7650674 10.1021/jm00017a005 Influenza B virus 2
11300878 10.1021/jm001070j Unchecked 1
14521411 10.1021/jm0302593 Unchecked 1
18255197 10.1016/j.ejmech.2007.04.011 Neuraminidase 1

Data from ChEMBL 36 via Core Engine