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

CHEMBL1170348

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
CCONC(=O)OC(c1ccccc1)c1cccc(C(C)C(=O)NOCC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1170348
Phase Preclinical
Structure Type MOL
InChI Key MQRCQKIPAZHXJO-UHFFFAOYSA-N
0
Targets
6
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

386.4
MW (Da)
3.62
ALogP
5
HBA
2
HBD
85.9
PSA (Ų)
0.64
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H26N2O5
MW 386.45
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.45

Activity Summary

IC50 6 meas.

Literature References

PubMed DOI Target Context # Activities
32214761 10.1007/s00044-010-9309-2 Radical scavenging activity 4
20434240 10.1016/j.ejmech.2010.04.008 Radical scavenging activity 4
32214761 10.1007/s00044-010-9309-2 Coxsackievirus B4 2
20434240 10.1016/j.ejmech.2010.04.008 NON-PROTEIN TARGET 2
32214761 10.1007/s00044-010-9309-2 Vesicular stomatitis virus 2
32214761 10.1007/s00044-010-9309-2 Influenza A virus 2
20434240 10.1016/j.ejmech.2010.04.008 Influenza A virus 2
20434240 10.1016/j.ejmech.2010.04.008 Vesicular stomatitis virus 2
32214761 10.1007/s00044-010-9309-2 No relevant target 2
20434240 10.1016/j.ejmech.2010.04.008 Coxsackievirus B4 2
20434240 10.1016/j.ejmech.2010.04.008 Human respirovirus 3 1
20434240 10.1016/j.ejmech.2010.04.008 Influenza B virus 1
20434240 10.1016/j.ejmech.2010.04.008 Respiratory syncytial virus 1
20434240 10.1016/j.ejmech.2010.04.008 Sindbis virus 1
20434240 10.1016/j.ejmech.2010.04.008 Mammalian orthoreovirus 1 1
20434240 10.1016/j.ejmech.2010.04.008 Vaccinia virus 1
20434240 10.1016/j.ejmech.2010.04.008 Human alphaherpesvirus 2 1
20434240 10.1016/j.ejmech.2010.04.008 CCRF-CEM 1
20434240 10.1016/j.ejmech.2010.04.008 FM3A 1
20434240 10.1016/j.ejmech.2010.04.008 L1210 1

Data from ChEMBL 36 via Core Engine