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Compound Detail

CHEMBL5986184

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CC(C)Cn1cc(-c2cnc(Nc3cc(F)cc(F)c3)nc2Nc2ccc3c(c2)CNCC3)cn1

Basic Information

ChEMBL ID CHEMBL5986184
Phase Preclinical
Structure Type MOL
InChI Key QKJUNBIPFNGGAT-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

475.6
MW (Da)
5.41
ALogP
7
HBA
3
HBD
79.7
PSA (Ų)
0.33
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H27F2N7
MW 475.55
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.33

Activity Summary

IC50 3 meas. best 9.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase receptor TYRO3
CHEMBL5314
IC50 9.8 9.8 0.2 1
Tyrosine-protein kinase Mer
CHEMBL5331
IC50 6.07 6.07 850.0 1
Tyrosine-protein kinase receptor UFO
CHEMBL4895
IC50 6.02 6.02 960.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine