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Compound Detail

CHEMBL108303

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CCCCCCCC/C=C1\CC([C@H](CO)OC(=O)CCCCCCCC)OC1=O

Basic Information

ChEMBL ID CHEMBL108303
Phase Preclinical
Structure Type MOL
InChI Key WAXUSWRZNQYUAJ-OTSXYQFISA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

410.6
MW (Da)
5.63
ALogP
5
HBA
1
HBD
72.8
PSA (Ų)
0.19
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H42O5
MW 410.60
Aromatic Rings 0
Heavy Atoms 29
NP-Likeness 1.33

Activity Summary

Ki 2 meas. best 8.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein kinase C alpha type
CHEMBL299
Ki 8.92 7.42 1.2 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10966739 10.1021/jm990613q Protein kinase C alpha type 2
10966739 10.1021/jm990613q No relevant target 1

Data from ChEMBL 36 via Core Engine