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Compound Detail

CHEMBL278445

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COc1cc2c(cc1OC)C(=O)c1cc(OC)c(OC)cc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL278445
Phase Preclinical
Structure Type MOL
InChI Key WAKICGWWAOUTLO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

328.3
MW (Da)
2.50
ALogP
6
HBA
0
HBD
71.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H16O6
MW 328.32
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.23

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00326-O Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine