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

CHEMBL375925

CYATHUSAL A
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
C/C=C/c1cc2c(c(=O)o1)-c1c(O)c(O)c(OC)c(C=O)c1CO2

Basic Information

ChEMBL ID CHEMBL375925
Name CYATHUSAL A
Phase Preclinical
Structure Type MOL
InChI Key SHZXMBWJQUATLH-ONEGZZNKSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

330.3
MW (Da)
2.46
ALogP
7
HBA
2
HBD
106.2
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H14O7
MW 330.29
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 1.91

Activity Summary

EC50 2 meas. best 5.11

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
NON-PROTEIN TARGET
CHEMBL3879801
EC50 5.11 5.11 7860.0 1
Radical scavenging activity
CHEMBL613712
EC50 4.38 4.38 41590.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
17511503 10.1021/np060637h NON-PROTEIN TARGET 1
17511503 10.1021/np060637h Radical scavenging activity 1

Data from ChEMBL 36 via Core Engine