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Compound Detail

CHEMBL3703680

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CC(NC(=O)Cc1cc(F)cc(F)c1)C(=O)NC1N=C(c2ccccc2)c2ccccc2N(C)C1=O

Basic Information

ChEMBL ID CHEMBL3703680
Phase Preclinical
Structure Type MOL
InChI Key JNGZXGGOCLZBFB-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

490.5
MW (Da)
2.97
ALogP
4
HBA
2
HBD
90.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H24F2N4O3
MW 490.51
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.66

Activity Summary

IC50 1 meas. best 8.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Gamma-secretase-activating protein
CHEMBL3638343
IC50 8.92 8.92 1.2 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine