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Compound Detail

CHEMBL5419567

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COc1cccc2oc(-c3ccccc3C(F)(F)F)cc(=O)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5419567
Phase Preclinical
Structure Type MOL
InChI Key ZGTGKUZYZRPICZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

320.3
MW (Da)
4.49
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H11F3O3
MW 320.27
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness 0.05

Literature References

PubMed DOI Target Context # Activities
36621139 10.1016/j.ejmech.2022.115044 DNA polymerase eta 1

Data from ChEMBL 36 via Core Engine