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Compound Detail

CHEMBL3410641

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Cc1ccc(OCC(=O)c2cc(C)c(O)cc2O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3410641
Phase Preclinical
Structure Type MOL
InChI Key UOBGWTOQZALQPG-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

272.3
MW (Da)
2.98
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C16H16O4
MW 272.30
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.28

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
25581017 10.1021/jm5018187 Krueppel-like factor 10 4
25581017 10.1021/jm5018187 Krueppel-like factor 1 2
25581017 10.1021/jm5018187 T-cell 2

Data from ChEMBL 36 via Core Engine