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Compound Detail

CHEMBL480393

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CC(=O)c1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL480393
Phase Preclinical
Structure Type MOL
InChI Key AERZCUPHFMXXLC-FDYHWXHSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
-0.59
ALogP
7
HBA
4
HBD
116.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H16O7
MW 284.26
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 2.00

Literature References

PubMed DOI Target Context # Activities
19097778 10.1016/j.bmcl.2008.11.112 Solute carrier family 28 member 3 1

Data from ChEMBL 36 via Core Engine