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Compound Detail

CHEMBL2424810

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COC(=O)CCN(O)C(=O)CCCCCCCCC(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2424810
Phase Preclinical
Structure Type MOL
InChI Key RIZSDSAXFUJCIG-UHFFFAOYSA-N
0
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

301.4
MW (Da)
3.54
ALogP
4
HBA
1
HBD
66.8
PSA (Ų)
0.26
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H31NO4
MW 301.43
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness 0.41

Activity Summary

IC50 3 meas.

Literature References

PubMed DOI Target Context # Activities
23964788 10.1021/jm400624b Lysine-specific demethylase 6A 1
23964788 10.1021/jm400624b Lysine-specific demethylase 2A 1
23964788 10.1021/jm400624b Lysine-specific demethylase 5A 1
23964788 10.1021/jm400624b Lysine-specific demethylase 4C 1
23964788 10.1021/jm400624b Lysine-specific demethylase 4A 1
23964788 10.1021/jm400624b Histone lysine demethylase PHF8 1

Data from ChEMBL 36 via Core Engine