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Compound Detail

CHEMBL5941362

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Cc1cc(NC2CNC2)nc(-c2cnc3ccc(Cl)cn23)c1

Basic Information

ChEMBL ID CHEMBL5941362
Phase Preclinical
Structure Type MOL
InChI Key XRXLOCXDGIXXOY-UHFFFAOYSA-N
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

313.8
MW (Da)
2.74
ALogP
5
HBA
2
HBD
54.2
PSA (Ų)
0.78
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16ClN5
MW 313.79
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.59

Activity Summary

IC50 3 meas. best 6.54

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Receptor-type tyrosine-protein kinase FLT3
CHEMBL1974
IC50 6.54 6.54 291.0 1
Unchecked
CHEMBL612545
IC50 6.54 6.54 291.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine