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Compound Detail

CHEMBL1172752

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O=C(O)c1ccc2c(c1)C(=O)N(c1cccc(O)c1)C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1172752
Phase Preclinical
Structure Type MOL
InChI Key VCROVLIVVNWJOU-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

283.2
MW (Da)
1.89
ALogP
4
HBA
2
HBD
94.9
PSA (Ų)
0.82
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 C15H9NO5
MW 283.24
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.64

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
20627595 10.1016/j.bmc.2010.05.030 Unchecked 2

Data from ChEMBL 36 via Core Engine