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Compound Detail

CHEMBL5270170

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Cc1cc(Nc2cc3c(cn2)ncc(=O)n3-c2ccc(N)cc2)ncc1NC1CCN(C)CC1

Basic Information

ChEMBL ID CHEMBL5270170
Phase Preclinical
Structure Type MOL
InChI Key IKCFODIWVHZXJF-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

456.6
MW (Da)
3.32
ALogP
9
HBA
3
HBD
114.0
PSA (Ų)
0.39
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H28N8O
MW 456.55
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -1.01

Activity Summary

IC50 2 meas. best 6.46

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Receptor-type tyrosine-protein kinase FLT3
CHEMBL1974
IC50 6.46 6.41 343.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36638621 10.1016/j.bmc.2023.117155 Receptor-type tyrosine-protein kinase FLT3 2

Data from ChEMBL 36 via Core Engine