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Compound Detail

CHEMBL461059

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NC(=O)/C(O)=C/C(=O)C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL461059
Phase Preclinical
Structure Type MOL
InChI Key ZUDLXXHZFJFYJJ-TWGQIWQCSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

197.2
MW (Da)
1.06
ALogP
3
HBA
2
HBD
80.4
PSA (Ų)
0.52
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 C10H15NO3
MW 197.23
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.12

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12646026 10.1021/jm020334u Polymerase acidic protein 1
19112024 10.1016/j.bmc.2008.11.075 unidentified influenza virus 1
7695269 10.1128/aac.38.12.2827 Polymerase acidic protein 1

Data from ChEMBL 36 via Core Engine