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Compound Detail

CHEMBL4079157

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CC(C)(C)OC(=O)Nc1ccc2c(c1)C(NC(=O)Nc1ccccc1C(F)(F)F)CC(C)(C)O2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4079157
Phase Preclinical
Structure Type MOL
InChI Key PHFJTFLMBYSGFF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

479.5
MW (Da)
6.48
ALogP
4
HBA
3
HBD
88.7
PSA (Ų)
0.47
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28F3N3O4
MW 479.50
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -1.13

Literature References

PubMed DOI Target Context # Activities
28475330 10.1021/acs.jmedchem.7b00533 Unchecked 4
28475330 10.1021/acs.jmedchem.7b00533 Hs 683 1
28475330 10.1021/acs.jmedchem.7b00533 T98G 1

Data from ChEMBL 36 via Core Engine