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Compound Detail

CHEMBL3930195

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Cc1ccccc1-c1nc2ccccc2c(=O)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3930195
Phase Preclinical
Structure Type MOL
InChI Key TVFWFWOQIWIDNS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

236.3
MW (Da)
2.90
ALogP
2
HBA
1
HBD
45.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
1
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 -0.89

Literature References

PubMed DOI Target Context # Activities
28110817 10.1016/j.bmc.2016.09.042 Unchecked 1

Data from ChEMBL 36 via Core Engine