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Compound Detail

CHEMBL4552174

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COC(=O)C(CC(=O)O)OC(=O)/C=C/c1ccc(O)c(O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4552174
Phase Preclinical
Structure Type MOL
InChI Key OLZMDDCORPZINI-HWKANZROSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

310.3
MW (Da)
0.67
ALogP
7
HBA
3
HBD
130.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C14H14O8
MW 310.26
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness 1.28

Literature References

PubMed DOI Target Context # Activities
31301930 10.1016/j.bmcl.2019.07.010 RAW264.7 1

Data from ChEMBL 36 via Core Engine