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Compound Detail

CHEMBL389234

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COc1cccc2cc(C(=O)c3cc4cccc(OC)c4o3)oc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL389234
Phase Preclinical
Structure Type MOL
InChI Key NJKZFKQLDOVFGO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

322.3
MW (Da)
4.43
ALogP
5
HBA
0
HBD
61.8
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14O5
MW 322.32
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -0.22

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