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Compound Detail

CHEMBL5415330

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CCCCCCCCOC(=O)[C@H](O)CCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5415330
Phase Preclinical
Structure Type MOL
InChI Key UJZOKTKSGUOCCM-LLVKDONJSA-N
0
Targets
5
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

260.3
MW (Da)
2.12
ALogP
4
HBA
2
HBD
83.8
PSA (Ų)
0.44
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H24O5
MW 260.33
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 0.98

Activity Summary

EC50 5 meas.

Literature References

PubMed DOI Target Context # Activities
38294854 10.1021/acs.jmedchem.3c01820 Methylcytosine dioxygenase TET1 2
38294854 10.1021/acs.jmedchem.3c01820 Methylcytosine dioxygenase TET2 2
38294854 10.1021/acs.jmedchem.3c01820 Methylcytosine dioxygenase TET3 2
38294854 10.1021/acs.jmedchem.3c01820 U2OS 1

Data from ChEMBL 36 via Core Engine