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Compound Detail

CHEMBL4847806

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O=C(O)/C=C/C(=O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4847806
Phase Preclinical
Structure Type MOL
InChI Key KRSRJVGQNCNEFU-OWOJBTEDSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

144.1
MW (Da)
-0.72
ALogP
3
HBA
2
HBD
91.7
PSA (Ų)
0.40
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H4O5
MW 144.08
Aromatic Rings 0
Heavy Atoms 10
NP-Likeness 0.86

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
33894507 10.1016/j.bmc.2021.116141 Methylcytosine dioxygenase TET2 1

Data from ChEMBL 36 via Core Engine