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Compound Detail

CHEMBL4459163

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CC(=O)Nc1ccc(C)cc1C(F)(F)C(=O)NC(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4459163
Phase Preclinical
Structure Type MOL
InChI Key AWQHFXBVMCKKGM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
2.57
ALogP
2
HBA
2
HBD
58.2
PSA (Ų)
0.89
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 C14H18F2N2O2
MW 284.31
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -1.18

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