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Compound Detail

CHEMBL3410740

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CCc1cc(C(=O)COc2ccc(-c3ccccc3)cc2)c(O)cc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3410740
Phase Preclinical
Structure Type MOL
InChI Key TUCIJRYGMPIFPE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
4.59
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H20O4
MW 348.40
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.23

Literature References

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

Data from ChEMBL 36 via Core Engine