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Compound Detail

CHEMBL357602

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O=C1NC(=O)c2c1c1c3ccccc3n3c1c1c2c2ccccc2n1[C@H]1CC[C@@H]3N1

Basic Information

ChEMBL ID CHEMBL357602
Phase Preclinical
Structure Type MOL
InChI Key OXEOHAXVZADDOC-IYBDPMFKSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

392.4
MW (Da)
4.18
ALogP
5
HBA
2
HBD
68.1
PSA (Ų)
0.39
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H16N4O2
MW 392.42
Aromatic Rings 5
Heavy Atoms 30
NP-Likeness 0.32

Activity Summary

IC50 1 meas. best 6.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein kinase C (PKC)
CHEMBL2093867
IC50 6.64 6.64 230.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Protein kinase C (PKC) IC50 = 230.0 nM 6.64 Inhibition of protein kinase C (PKC) isozyme -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(94)80024-3 Protein kinase C (PKC) 1

Data from ChEMBL 36 via Core Engine