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Compound Detail

CHEMBL292383

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CC(C)CC(=O)OC[C@H](CO)OC(=O)CC(C)C

Basic Information

ChEMBL ID CHEMBL292383
Phase Preclinical
Structure Type MOL
InChI Key JIPGBMOUHOPULY-NSHDSACASA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

260.3
MW (Da)
1.53
ALogP
5
HBA
1
HBD
72.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C13H24O5
MW 260.33
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 1.13

Activity Summary

Ki 1 meas. best 5.85

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein kinase C alpha type
CHEMBL2213
Ki 5.85 5.85 1409.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11384235 10.1021/jm010052e No relevant target 1
11384235 10.1021/jm010052e Protein kinase C alpha type 1

Data from ChEMBL 36 via Core Engine