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Compound Detail

CHEMBL3924443

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Cc1c2c(cc3c1N(Cc1ccc(C(F)(F)F)cc1)C(=O)C3=O)-c1ccccc1OC2CC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3924443
Phase Preclinical
Structure Type MOL
InChI Key SSVNDXGBGFKQJX-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

481.4
MW (Da)
5.32
ALogP
4
HBA
1
HBD
83.9
PSA (Ų)
0.51
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H18F3NO5
MW 481.43
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.23

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
27487567 10.1016/j.ejmech.2016.07.044 Unchecked 1

Data from ChEMBL 36 via Core Engine