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Compound Detail

CHEMBL4562829

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CC(=O)Nc1ccccc1C(F)(F)C(=O)Nc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4562829
Phase Preclinical
Structure Type MOL
InChI Key LMBYRXOYAROBLX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

304.3
MW (Da)
3.38
ALogP
2
HBA
2
HBD
58.2
PSA (Ų)
0.91
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14F2N2O2
MW 304.30
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.22

Literature References

PubMed DOI Target Context # Activities
31311700 10.1016/j.bmc.2019.07.022 Arginase 4
31311700 10.1016/j.bmc.2019.07.022 Leishmania amazonensis 1

Data from ChEMBL 36 via Core Engine