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Compound Detail

CHEMBL5404662

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Cc1nc2ccccc2n(CC(=O)Nc2ccc(C(=O)NNC(=O)c3ccccc3O)cc2)c1=O

Basic Information

ChEMBL ID CHEMBL5404662
Phase Preclinical
Structure Type MOL
InChI Key JTMLGYOZNRPPEA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

471.5
MW (Da)
2.12
ALogP
7
HBA
4
HBD
142.4
PSA (Ų)
0.33
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H21N5O5
MW 471.47
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.66

Activity Summary

IC50 1 meas. best 5.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 5.92 5.92 1190.0 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