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Compound Detail

CHEMBL5082659

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O=C(Nc1ccccc1/C=C/c1ccc(F)cc1)c1cccnn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5082659
Phase Preclinical
Structure Type MOL
InChI Key ZUXJPEKFHSAUDR-JXMROGBWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

319.3
MW (Da)
4.04
ALogP
3
HBA
1
HBD
54.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14FN3O
MW 319.34
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.38

Literature References

PubMed DOI Target Context # Activities
34624824 10.1016/j.ejmech.2021.113887 Alpha-synuclein 1

Data from ChEMBL 36 via Core Engine