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Compound Detail

CHEMBL4640911

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COc1cccc2c1NC(C(=O)Nc1ccccc1)C1CC=CC21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4640911
Phase Preclinical
Structure Type MOL
InChI Key SDPYPHRUFXBJFY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

320.4
MW (Da)
3.79
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.85
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20N2O2
MW 320.39
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.41

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