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Compound Detail

CHEMBL1606435

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Basic Information

ChEMBL ID CHEMBL1606435
Phase Preclinical
Structure Type MOL
InChI Key LEQAOMBKQFMDFZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

58.0
MW (Da)
-0.62
ALogP
2
HBA
0
HBD
34.1
PSA (Ų)
0.30
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C2H2O2
MW 58.04
Aromatic Rings 0
Heavy Atoms 4
NP-Likeness 0.79

Literature References

PubMed DOI Target Context # Activities
28197313 10.1021/acsmedchemlett.6b00417 Myeloperoxidase 1

Data from ChEMBL 36 via Core Engine