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Compound Detail

CHEMBL342184

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COc1cc(NC(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc(OC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL342184
Phase Preclinical
Structure Type MOL
InChI Key HVYBDNCOJDQXDF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

389.9
MW (Da)
5.12
ALogP
5
HBA
2
HBD
72.5
PSA (Ų)
0.63
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H16ClN3O3S
MW 389.86
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.96

Literature References

PubMed DOI Target Context # Activities
14643347 10.1016/j.bmcl.2003.09.013 Staphylococcus aureus 1

Data from ChEMBL 36 via Core Engine