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Compound Detail

CHEMBL465167

KAZINOL A
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CC(C)=CCc1cc([C@@H]2CCc3ccc(O)cc3O2)c(CC=C(C)C)c(O)c1O

Basic Information

ChEMBL ID CHEMBL465167
Name KAZINOL A
Phase Preclinical
Structure Type MOL
InChI Key QXHVECWDOBLWPW-QFIPXVFZSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

394.5
MW (Da)
5.89
ALogP
4
HBA
3
HBD
69.9
PSA (Ų)
0.44
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C25H30O4
MW 394.51
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 1.97

Activity Summary

IC50 3 meas. best 4.94

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
NON-PROTEIN TARGET
CHEMBL3879801
IC50 4.94 4.6267 11400.0 3

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
8864236 10.1021/np960376j NON-PROTEIN TARGET 6

Data from ChEMBL 36 via Core Engine