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Compound Detail

CHEMBL1979892

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O=C(NO)c1ccc(C(=O)NO)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1979892
Phase Preclinical
Structure Type MOL
InChI Key YAJCYOUHZABXFT-UHFFFAOYSA-N
0
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

196.2
MW (Da)
-0.08
ALogP
4
HBA
4
HBD
98.7
PSA (Ų)
0.39
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H8N2O4
MW 196.16
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -0.45

Activity Summary

IC50 3 meas.

Literature References

PubMed DOI Target Context # Activities
137981 10.1021/jm00212a010 Enterococcus faecium 5
137981 10.1021/jm00212a010 Lacticaseibacillus casei 5
137981 10.1021/jm00212a010 NON-PROTEIN TARGET 2
137981 10.1021/jm00212a010 Plasmodium berghei 2
137981 10.1021/jm00212a010 Escherichia coli 1

Data from ChEMBL 36 via Core Engine