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Compound Detail

CHEMBL3214424

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Cc1ccc2nc(C)c(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)cc2c1

Basic Information

ChEMBL ID CHEMBL3214424
Phase Preclinical
Structure Type MOL
InChI Key OFBSFFNWJQIYTL-RGVLZGJSSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.52
ALogP
5
HBA
1
HBD
97.5
PSA (Ų)
0.44
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 C19H16N4O3
MW 348.36
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -2.11

Activity Summary

IC50 1 meas. best 4.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mitochondrial import inner membrane translocase subunit TIM10
CHEMBL1741194
IC50 4.59 4.59 25800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

Data from ChEMBL 36 via Core Engine