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Compound Detail

CHEMBL4161571

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NC(=O)c1cc2ccccc2n1-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4161571
Phase Preclinical
Structure Type MOL
InChI Key SHVVLJKMYJRHOL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

236.3
MW (Da)
2.73
ALogP
2
HBA
1
HBD
48.0
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 C15H12N2O
MW 236.27
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness -1.09

Literature References

PubMed DOI Target Context # Activities
30034585 10.1021/acsmedchemlett.7b00505 Group 10 secretory phospholipase A2 1

Data from ChEMBL 36 via Core Engine