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Compound Detail

CHEMBL5422526

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NC(=O)CCn1cc(-c2ccc3ncnc(Nc4ccc(F)c(O)c4)c3c2)nn1

Basic Information

ChEMBL ID CHEMBL5422526
Phase Preclinical
Structure Type MOL
InChI Key VCBAAPOFZFWPPT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

393.4
MW (Da)
2.35
ALogP
8
HBA
3
HBD
131.8
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16FN7O2
MW 393.38
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -1.65

Activity Summary

IC50 1 meas. best 7.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 7.19 7.19 64.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
38389872 10.1039/d3md00506b Vascular endothelial growth factor receptor 2 1

Data from ChEMBL 36 via Core Engine