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Compound Detail

CHEMBL4644096

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Cc1cccc2c1NC(C(=O)O)C1CC=CC21

Basic Information

ChEMBL ID CHEMBL4644096
Phase Preclinical
Structure Type MOL
InChI Key MLQAOQXASUWCLY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

229.3
MW (Da)
2.53
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.73
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15NO2
MW 229.28
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.14

Literature References

PubMed DOI Target Context # Activities
32631520 10.1016/j.bmcl.2020.127300 Protein FosB 1
32631520 10.1016/j.bmcl.2020.127300 Protein fosB/Transcription factor jun-D 1

Data from ChEMBL 36 via Core Engine