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Compound Detail

CHEMBL157181

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COC(=O)c1cccc(-n2c(=O)[nH]c(=O)c3ccccc32)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL157181
Phase Preclinical
Structure Type MOL
InChI Key GOUWLELLHQRVOH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

296.3
MW (Da)
1.47
ALogP
5
HBA
1
HBD
81.2
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 C16H12N2O4
MW 296.28
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.08

Literature References

PubMed DOI Target Context # Activities
1995886 10.1021/jm00106a024 Phosphodiesterase 4 1
1995886 10.1021/jm00106a024 Unchecked 1
1995886 10.1021/jm00106a024 Mus musculus 1
1995886 10.1021/jm00106a024 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine