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Compound Detail

CHEMBL294450

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O=C1OC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL294450
Phase Preclinical
Structure Type MOL
InChI Key BEDSOEWYLAPDOL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

328.3
MW (Da)
3.64
ALogP
3
HBA
2
HBD
75.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H12N2O3
MW 328.33
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness 0.33

Literature References

PubMed DOI Target Context # Activities
1732526 10.1021/jm00079a024 Protein kinase C gamma type 1
1874734 10.1016/s0021-9258(18)98476-0 Unchecked 1

Data from ChEMBL 36 via Core Engine