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Compound Detail

CHEMBL5768024

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CC(C)c1nc2c(O)cc(N3CCOCC3)cc2n1Cc1cccc2ccccc12

Basic Information

ChEMBL ID CHEMBL5768024
Phase Preclinical
Structure Type MOL
InChI Key LZWXRZNGKKZRTB-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

401.5
MW (Da)
4.90
ALogP
5
HBA
1
HBD
50.5
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H27N3O2
MW 401.51
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.00

Activity Summary

IC50 1 meas. best 8.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta
CHEMBL5554
IC50 8.7 8.7 2.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine