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Compound Detail

CHEMBL507342

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CC1=C(CO)c2c(C)c(CCO)c(C)c(O)c2C1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL507342
Phase Preclinical
Structure Type MOL
InChI Key ADOGGMLVBFYCON-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

264.3
MW (Da)
1.36
ALogP
4
HBA
4
HBD
80.9
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H20O4
MW 264.32
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness 2.21

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12608875 10.1021/np0204085 HL-60 1

Data from ChEMBL 36 via Core Engine