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Compound Detail

CHEMBL258604

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NC(=O)C(c1ccccc1)(c1ccccc1)c1ccc(F)cc1

Basic Information

ChEMBL ID CHEMBL258604
Phase Preclinical
Structure Type MOL
InChI Key JHPLFDBQYVMFCT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

305.4
MW (Da)
3.65
ALogP
1
HBA
1
HBD
43.1
PSA (Ų)
0.73
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 C20H16FNO
MW 305.35
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.64

Activity Summary

IC50 1 meas. best 7.4

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Intermediate conductance calcium-activated potassium channel protein 4
CHEMBL4305
IC50 7.4 7.4 40.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
18232633 10.1021/jm070663s Intermediate conductance calcium-activated potassium channel protein 4 1
18232633 10.1021/jm070663s Liver 1
18232633 10.1021/jm070663s No relevant target 1

Data from ChEMBL 36 via Core Engine