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Compound Detail

CHEMBL466355

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CCCCOC(=O)c1ccc(Cl)cc1NC(=O)c1c(Cl)cccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL466355
Phase Preclinical
Structure Type MOL
InChI Key LCFMJBRQLWMYBH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

400.7
MW (Da)
5.86
ALogP
3
HBA
1
HBD
55.4
PSA (Ų)
0.49
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H16Cl3NO3
MW 400.69
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -1.28

Literature References

PubMed DOI Target Context # Activities
18407506 10.1016/j.bmc.2008.03.071 Blood 4

Data from ChEMBL 36 via Core Engine