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Compound Detail

CHEMBL242411

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CN(C)c1ccc(-c2cn3cc(Br)cc(C#N)c3n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL242411
Phase Preclinical
Structure Type MOL
InChI Key GCDHVSBXCVJOMI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

341.2
MW (Da)
3.70
ALogP
4
HBA
0
HBD
44.3
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H13BrN4
MW 341.21
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.82

Literature References

PubMed DOI Target Context # Activities
17722900 10.1021/jm0702231 Amyloid-beta precursor protein 1

Data from ChEMBL 36 via Core Engine