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Compound Detail

CHEMBL358053

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COc1ccc(C(=O)CCc2ccc(Cl)cc2Cl)c(OC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL358053
Phase Preclinical
Structure Type MOL
InChI Key BNTLJSAXYWXSKT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

339.2
MW (Da)
4.83
ALogP
3
HBA
0
HBD
35.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16Cl2O3
MW 339.22
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.68

Literature References

PubMed DOI Target Context # Activities
8544179 10.1021/jm00026a010 Plasmodium falciparum 4

Data from ChEMBL 36 via Core Engine