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Compound Detail

CHEMBL276476

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Cn1c2ccccc2c(=O)n1Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL276476
Phase Preclinical
Structure Type MOL
InChI Key HBWGTSIDRXRGNT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

238.3
MW (Da)
2.39
ALogP
3
HBA
0
HBD
26.9
PSA (Ų)
0.67
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 C15H14N2O
MW 238.29
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness -0.80

Literature References

PubMed DOI Target Context # Activities
23124218 10.1016/j.ejmech.2012.10.009 Trypanosoma cruzi 3
23124218 10.1016/j.ejmech.2012.10.009 J774 3
1848292 10.1021/jm00107a023 Polyunsaturated fatty acid 5-lipoxygenase 2

Data from ChEMBL 36 via Core Engine