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Compound Detail

CHEMBL286462

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C=C(F)C(=O)Nc1cc(C(=O)Nc2ccccc2)n(C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL286462
Phase Preclinical
Structure Type MOL
InChI Key CZFWHQPONYFKLO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

287.3
MW (Da)
2.70
ALogP
3
HBA
2
HBD
63.1
PSA (Ų)
0.85
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 C15H14FN3O2
MW 287.29
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.13

Literature References

PubMed DOI Target Context # Activities
12031321 10.1016/s0960-894x(02)00177-4 L1210 1
12031321 10.1016/s0960-894x(02)00177-4 Caco-2 1

Data from ChEMBL 36 via Core Engine