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Compound Detail

CHEMBL3415884

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O=Cc1cc(O)c(O)cc1O

Basic Information

ChEMBL ID CHEMBL3415884
Phase Preclinical
Structure Type MOL
InChI Key WNCNWLVQSHZVKV-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

154.1
MW (Da)
0.62
ALogP
4
HBA
3
HBD
77.8
PSA (Ų)
0.31
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C7H6O4
MW 154.12
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness 1.23

Activity Summary

EC50 1 meas. best 5.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
No relevant target
CHEMBL2362975
EC50 5.22 5.22 5970.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
No relevant target EC50 = 5970.0 nM 5.22 Antioxidant activity assessed as DPPH free radical scavenging activity incubated... 25752525

Literature References

Data from ChEMBL 36 via Core Engine