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Compound Detail

CHEMBL4536623

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CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(-c2ccc(F)cc2)n1

Basic Information

ChEMBL ID CHEMBL4536623
Phase Preclinical
Structure Type MOL
InChI Key IXUTVZSEBCAOOT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

386.9
MW (Da)
5.61
ALogP
3
HBA
2
HBD
59.0
PSA (Ų)
0.61
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20ClFN4O
MW 386.86
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -2.26

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C6MD00262E Mitogen-activated protein kinase 14 3

Data from ChEMBL 36 via Core Engine