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Compound Detail

CHEMBL5925841

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Cc1cc(NC(=O)Nc2ccc(-c3cn(C4CC4)c4ncnc(N)c34)cc2F)on1

Basic Information

ChEMBL ID CHEMBL5925841
Phase Preclinical
Structure Type MOL
InChI Key QPAIXCRTEWSZHP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

407.4
MW (Da)
4.09
ALogP
7
HBA
3
HBD
123.9
PSA (Ų)
0.47
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H18FN7O2
MW 407.41
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.65

Activity Summary

IC50 1 meas. best 6.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Serine/threonine-protein kinase Nek7
CHEMBL4849
IC50 6.0 6.0 1000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine