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Compound Detail

CHEMBL5820349

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COc1ccc(C(F)(F)CNc2ncc(-c3cnn(C)c3)c(NC3CCCCC3)n2)cc1

Basic Information

ChEMBL ID CHEMBL5820349
Phase Preclinical
Structure Type MOL
InChI Key FJBAHMZINBXDLN-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

442.5
MW (Da)
4.83
ALogP
7
HBA
2
HBD
76.9
PSA (Ų)
0.52
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H28F2N6O
MW 442.51
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.27

Activity Summary

IC50 2 meas. best 6.29

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase receptor UFO
CHEMBL4895
IC50 6.29 6.29 510.0 1
Tyrosine-protein kinase receptor TYRO3
CHEMBL5314
IC50 5.99 5.99 1030.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine