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Compound Detail

CHEMBL4448371

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O=C1Nc2ccccc2N/C1=C\C(=O)c1ccco1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4448371
Phase Preclinical
Structure Type MOL
InChI Key PFSLOUBGSAQQHS-FLIBITNWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

254.2
MW (Da)
2.41
ALogP
4
HBA
2
HBD
71.3
PSA (Ų)
0.64
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H10N2O3
MW 254.25
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.59

Literature References

PubMed DOI Target Context # Activities
31268308 10.1021/acs.jmedchem.9b00537 Mitogen-activated protein kinase 10 2

Data from ChEMBL 36 via Core Engine