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Compound Detail

CHEMBL377929

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CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1

Basic Information

ChEMBL ID CHEMBL377929
Phase Preclinical
Structure Type MOL
InChI Key JGQHLETVKDCCET-NRIIQWGUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

318.5
MW (Da)
5.10
ALogP
2
HBA
0
HBD
6.5
PSA (Ų)
0.68
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H26N2
MW 318.46
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.08

Activity Summary

Ki 1 meas. best 6.08

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Amyloid-beta precursor protein
CHEMBL2487
Ki 6.08 6.08 837.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16640346 10.1021/jm051020k Amyloid-beta precursor protein 2

Data from ChEMBL 36 via Core Engine