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Compound Detail

CHEMBL377384

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O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc2c[nH]nc2c1O

Basic Information

ChEMBL ID CHEMBL377384
Phase Preclinical
Structure Type MOL
InChI Key XOSDBCNLJLOERI-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

345.4
MW (Da)
4.31
ALogP
4
HBA
3
HBD
87.2
PSA (Ų)
0.51
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 C20H15N3O3
MW 345.36
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.05

Activity Summary

IC50 1 meas. best 6.9

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mitochondrial complex II; succinate dehydrogenase
CHEMBL613815
IC50 6.9 6.9 127.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16854082 10.1021/jm060408s Parastagonospora nodorum 2
16854082 10.1021/jm060408s Mitochondrial complex II; succinate dehydrogenase 2

Data from ChEMBL 36 via Core Engine