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Compound Detail

CHEMBL5982824

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Cc1nc2c(F)cc(N3CCOCC3)cc2n1Cc1cccc2ccccc12

Basic Information

ChEMBL ID CHEMBL5982824
Phase Preclinical
Structure Type MOL
InChI Key GDRAKNDUKWAGIF-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
4.52
ALogP
4
HBA
0
HBD
30.3
PSA (Ų)
0.53
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H22FN3O
MW 375.45
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.60

Activity Summary

IC50 1 meas. best 9.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta
CHEMBL5554
IC50 9.0 9.0 1.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine