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Compound Detail

CHEMBL278721

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O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NN1CCN(CCO)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL278721
Phase Preclinical
Structure Type MOL
InChI Key GGMKBIYDBNJPIJ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

400.3
MW (Da)
2.37
ALogP
4
HBA
3
HBD
67.8
PSA (Ų)
0.68
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 C15H18F6N4O2
MW 400.32
Aromatic Rings 1
Heavy Atoms 27
NP-Likeness -1.44

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
11354364 10.1016/s0960-894x(01)00160-3 Staphylococcus aureus 1
11354364 10.1016/s0960-894x(01)00160-3 Bacteria 1

Data from ChEMBL 36 via Core Engine