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Compound Detail

CHEMBL237233

N-BENZYL-4-METHOXYANILINE
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COc1ccc(NCc2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL237233
Name N-BENZYL-4-METHOXYANILINE
Phase Preclinical
Structure Type MOL
InChI Key LIJJGMDKVVOEFT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

213.3
MW (Da)
3.31
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15NO
MW 213.28
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.96

Literature References

PubMed DOI Target Context # Activities
- 10.1007/s00044-013-0493-8 Acetylcholinesterase 2
17870540 10.1016/j.bmc.2007.08.048 L929 1
- 10.1007/s00044-013-0493-8 Cholinesterase 1

Data from ChEMBL 36 via Core Engine