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Compound Detail

CHEMBL520813

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NNC(=O)c1[nH]cnc1C(=O)Nc1ccccc1[N+](=O)[O-]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL520813
Phase Preclinical
Structure Type MOL
InChI Key GGNICRLLGZPDME-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

290.2
MW (Da)
0.17
ALogP
6
HBA
4
HBD
156.0
PSA (Ų)
0.27
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H10N6O4
MW 290.24
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.85

Literature References

PubMed DOI Target Context # Activities
19285872 10.1016/j.bmc.2009.02.041 Inhibitor of nuclear factor kappa-B kinase subunit beta 2

Data from ChEMBL 36 via Core Engine