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Compound Detail

CHEMBL1091870

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Cc1nc2ccc([N+](=O)[O-])cc2c(=O)n1C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1091870
Phase Preclinical
Structure Type MOL
InChI Key SJEBLQKZLGMHSW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

248.2
MW (Da)
0.54
ALogP
6
HBA
1
HBD
121.1
PSA (Ų)
0.58
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H8N4O4
MW 248.20
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.46

Literature References

PubMed DOI Target Context # Activities
20303768 10.1016/j.bmc.2010.02.025 SK-N-MC 1
20303768 10.1016/j.bmc.2010.02.025 HCT-116 1
20303768 10.1016/j.bmc.2010.02.025 ADMET 1
20303768 10.1016/j.bmc.2010.02.025 No relevant target 1

Data from ChEMBL 36 via Core Engine