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Compound Detail

CHEMBL2325380

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O=C(Nc1ccc(Cc2ccccc2)cc1)Nc1cc(C(F)(F)F)ccc1Oc1ccc(Cl)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2325380
Phase Preclinical
Structure Type MOL
InChI Key KIMJZOUFLVZESP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

531.4
MW (Da)
9.04
ALogP
2
HBA
2
HBD
50.4
PSA (Ų)
0.26
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H19Cl2F3N2O2
MW 531.36
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -1.42

Literature References

PubMed DOI Target Context # Activities
23313245 10.1016/j.bmcl.2012.12.022 Plasmodium falciparum 2

Data from ChEMBL 36 via Core Engine