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Compound Detail

CHEMBL481450

STILBOSTEMIN G
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COc1cc(CCc2cccc(O)c2OC)cc(O)c1C

Basic Information

ChEMBL ID CHEMBL481450
Name STILBOSTEMIN G
Phase Preclinical
Structure Type MOL
InChI Key DDKZTACJHBROQB-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

288.3
MW (Da)
3.21
ALogP
4
HBA
2
HBD
58.9
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H20O4
MW 288.34
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness 0.95

Activity Summary

IC50 1 meas. best 4.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 4.59 4.59 25800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 25800.0 nM 4.59 Ex vivo inhibition of leukotriene formation in calcium ionophore activated human... 15679323

Literature References

PubMed DOI Target Context # Activities
15679323 10.1021/np0497043 Unchecked 1

Data from ChEMBL 36 via Core Engine