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Compound Detail

CHEMBL4451744

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CN(C)C(=O)Cn1c2ccccc2c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4451744
Phase Preclinical
Structure Type MOL
InChI Key HLIZEAZXGXRHKD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

252.3
MW (Da)
2.88
ALogP
2
HBA
0
HBD
25.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16N2O
MW 252.32
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.14

Literature References

PubMed DOI Target Context # Activities
31419132 10.1021/acs.jmedchem.9b00980 Translocator protein 2
32920427 10.1016/j.ejmech.2020.112725 Translocator protein 2

Data from ChEMBL 36 via Core Engine