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Compound Detail

CHEMBL1469407

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Oc1nc2cc3ccccc3cc2nc1C(F)(F)F

Basic Information

ChEMBL ID CHEMBL1469407
Phase Preclinical
Structure Type MOL
InChI Key FLOKVRACNNBAGH-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

264.2
MW (Da)
3.51
ALogP
3
HBA
1
HBD
46.0
PSA (Ų)
0.63
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H7F3N2O
MW 264.21
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -0.88

Activity Summary

IC50 2 meas. best 5.54

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Female germline-specific tumor suppressor gld-1
CHEMBL1293302
IC50 5.54 5.54 2900.0 1
Polyadenylate-binding protein 1
CHEMBL1293286
IC50 4.33 4.33 46200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine