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Compound Detail

CHEMBL301337

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Cn1cc(C2=C(c3cccc(Cl)c3)C(=O)NC2=O)c2ccccc21

Basic Information

ChEMBL ID CHEMBL301337
Phase Preclinical
Structure Type MOL
InChI Key WDKNOTYYBBUUEH-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

336.8
MW (Da)
3.40
ALogP
3
HBA
1
HBD
51.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H13ClN2O2
MW 336.78
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.57

Activity Summary

IC50 1 meas. best 5.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein kinase C gamma type
CHEMBL3604
IC50 5.7 5.7 2000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1732526 10.1021/jm00079a024 Unchecked 2
1732526 10.1021/jm00079a024 Protein kinase C gamma type 1

Data from ChEMBL 36 via Core Engine