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Compound Detail

CHEMBL479098

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Fc1ccc(-c2cc(-c3ccc(F)cc3)n(-c3ccccc3)n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL479098
Phase Preclinical
Structure Type MOL
InChI Key SDRKZTNENZLOBY-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
5.48
ALogP
2
HBA
0
HBD
17.8
PSA (Ų)
0.49
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H14F2N2
MW 332.35
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.36

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
19143528 10.1021/jm800720a Fructose-1,6-bisphosphatase 1 1

Data from ChEMBL 36 via Core Engine