Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL590319

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCOC(=O)c1cc2cc(-c3ccc(OC)nc3)ccc2oc1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL590319
Phase Preclinical
Structure Type MOL
InChI Key BXYROBXRQXCYFD-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

325.3
MW (Da)
3.04
ALogP
6
HBA
0
HBD
78.6
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15NO5
MW 325.32
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.91

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
19932027 10.1016/j.bmc.2009.10.047 Unchecked 2
19932027 10.1016/j.bmc.2009.10.047 Radical scavenging activity 1

Data from ChEMBL 36 via Core Engine