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Compound Detail

CHEMBL26857

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Basic Information

ChEMBL ID CHEMBL26857
Phase Preclinical
Structure Type MOL
InChI Key UFOZXNZOYKGSQO-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

106.1
MW (Da)
-1.80
ALogP
4
HBA
3
HBD
81.5
PSA (Ų)
0.37
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C3H10N2O2
MW 106.12
Aromatic Rings 0
Heavy Atoms 7
NP-Likeness 0.74

Activity Summary

IC50 2 meas. best 7.41

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Ornithine decarboxylase
CHEMBL3511
IC50 7.41 7.41 39.0 1
T-24
CHEMBL614774
IC50 4.61 4.61 24400.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1573631 10.1021/jm00086a003 Ornithine decarboxylase 1
1573631 10.1021/jm00086a003 T-24 1

Data from ChEMBL 36 via Core Engine