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Compound Detail

CHEMBL376787

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Nc1ccc2oc(C(=O)c3cc4cc(N)ccc4o3)cc2c1

Basic Information

ChEMBL ID CHEMBL376787
Phase Preclinical
Structure Type MOL
InChI Key UMBJVNBINWLZLH-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

292.3
MW (Da)
3.57
ALogP
5
HBA
2
HBD
95.4
PSA (Ų)
0.43
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H12N2O3
MW 292.29
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness -0.27

Activity Summary

IC50 2 meas. best 6.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Receptor-type tyrosine-protein kinase FLT3
CHEMBL1974
IC50 6.22 6.22 600.0 1
Platelet-derived growth factor receptor beta
CHEMBL2749
IC50 5.92 5.92 1200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
17210255 10.1016/j.bmc.2006.12.011 Platelet-derived growth factor receptor beta 1
17210255 10.1016/j.bmc.2006.12.011 Receptor-type tyrosine-protein kinase FLT3 1

Data from ChEMBL 36 via Core Engine