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Compound Detail

CHEMBL4860862

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O=C(O)c1cc(C(=O)O)c2c(c1)C(=O)c1ccccc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4860862
Phase Preclinical
Structure Type MOL
InChI Key QTLAPAJQZWTXED-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

296.2
MW (Da)
1.86
ALogP
4
HBA
2
HBD
108.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H8O6
MW 296.23
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 0.43

Literature References

PubMed DOI Target Context # Activities
34225167 10.1016/j.bmc.2021.116292 Transthyretin 1

Data from ChEMBL 36 via Core Engine