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Compound Detail

CHEMBL284584

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O=C1Cc2ccccc2O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284584
Phase Preclinical
Structure Type MOL
InChI Key ACZGCWSMSTYWDQ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

134.1
MW (Da)
1.15
ALogP
2
HBA
0
HBD
26.3
PSA (Ų)
0.39
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C8H6O2
MW 134.13
Aromatic Rings 1
Heavy Atoms 10
NP-Likeness 0.76

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
15115404 10.1021/jm030473r NAD-dependent histone deacetylase SIR2 4
7332706 10.1021/jm00144a019 Rattus norvegicus 1
7332706 10.1021/jm00144a019 Cyclooxygenase 1
15916432 10.1021/jm0489713 Cytochrome P450 1A2 1
18572410 10.1016/j.bmc.2008.06.008 Serum paraoxonase/arylesterase 1 1

Data from ChEMBL 36 via Core Engine