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Compound Detail

CHEMBL5186130

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CC(C)=CCC1=C(O)C(=O)c2c(O)ccc(O)c2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5186130
Phase Preclinical
Structure Type MOL
InChI Key KNOSIOWNDGUGFJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

274.3
MW (Da)
2.65
ALogP
5
HBA
3
HBD
94.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C15H14O5
MW 274.27
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 1.92

Literature References

PubMed DOI Target Context # Activities
33333397 10.1016/j.ejmech.2020.113084 Plasmodium falciparum 1
38421618 10.1021/acs.jnatprod.3c01285 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine