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Compound Detail

CHEMBL2219511

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Nc1ccc(-c2ccc3cc(OCCF)ccc3n2)cc1

Basic Information

ChEMBL ID CHEMBL2219511
Phase Preclinical
Structure Type MOL
InChI Key ZGJOXECWZKCGBV-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

282.3
MW (Da)
3.83
ALogP
3
HBA
1
HBD
48.1
PSA (Ų)
0.74
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 C17H15FN2O
MW 282.32
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.01

Activity Summary

Ki 1 meas. best 7.23

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Microtubule-associated protein tau
CHEMBL1293224
Ki 7.23 7.23 59.3 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine