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Compound Detail

CHEMBL5270285

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Nc1ccc(-c2cnc(Cl)c(C(F)(F)F)c2)cn1

Basic Information

ChEMBL ID CHEMBL5270285
Phase Preclinical
Structure Type MOL
InChI Key YLIPKWOYAZYHGU-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

273.6
MW (Da)
3.40
ALogP
3
HBA
1
HBD
51.8
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H7ClF3N3
MW 273.64
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.48

Activity Summary

IC50 1 meas. best 4.33

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
CHEMBL3130
IC50 4.33 4.33 46616.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36706844 10.1016/j.bmcl.2023.129152 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform 1

Data from ChEMBL 36 via Core Engine