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Compound Detail

CHEMBL5864294

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Cc1ccc(Oc2ccc(C(F)(F)F)cc2C(=O)Nc2cc[nH]c(=O)c2)c(C)c1

Basic Information

ChEMBL ID CHEMBL5864294
Phase Preclinical
Structure Type MOL
InChI Key JZVFUROPKILZTE-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

402.4
MW (Da)
5.06
ALogP
3
HBA
2
HBD
71.2
PSA (Ų)
0.64
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H17F3N2O3
MW 402.37
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.28

Activity Summary

IC50 2 meas. best 7.75

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Sodium channel protein type 10 subunit alpha
CHEMBL5451
IC50 7.75 7.75 18.0 1
Unchecked
CHEMBL612545
IC50 7.75 7.75 18.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine