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Compound Detail

CHEMBL323085

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O=C1Nc2cc(F)ccc2/C1=C\c1ccc[nH]1

Basic Information

ChEMBL ID CHEMBL323085
Phase Preclinical
Structure Type MOL
InChI Key JFVLMRYDPQMRFA-YRNVUSSQSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

228.2
MW (Da)
2.65
ALogP
1
HBA
2
HBD
44.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H9FN2O
MW 228.23
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.87

Activity Summary

IC50 1 meas. best 6.15

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL3337
IC50 6.15 6.15 708.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10956210 10.1021/jm990609e Vascular endothelial growth factor receptor 2 1

Data from ChEMBL 36 via Core Engine