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Compound Detail

CHEMBL480665

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COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2[C@@H](CO)[C@H](O)C[C@H]12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL480665
Phase Preclinical
Structure Type MOL
InChI Key GTEDLLYKAJRTNK-CBQOGAMZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

406.4
MW (Da)
-3.18
ALogP
11
HBA
6
HBD
175.4
PSA (Ų)
0.25
QED
2
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 C17H26O11
MW 406.38
Aromatic Rings 0
Heavy Atoms 28
NP-Likeness 2.67

Literature References

PubMed DOI Target Context # Activities
15844957 10.1021/np0495985 NON-PROTEIN TARGET 2
15844957 10.1021/np0495985 Radical scavenging activity 1

Data from ChEMBL 36 via Core Engine