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Compound Detail

CHEMBL3937338

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OC[C@H]1O[C@@H](c2ccc[nH]2)[C@H](O)[C@@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3937338
Phase Preclinical
Structure Type MOL
InChI Key PADPYMJQCPJDGX-SPFKKGSWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

229.2
MW (Da)
-1.47
ALogP
5
HBA
5
HBD
105.9
PSA (Ų)
0.43
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H15NO5
MW 229.23
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 1.42

Literature References

PubMed DOI Target Context # Activities
27522507 10.1016/j.ejmech.2016.06.049 Glycogen phosphorylase, muscle form 2
27522507 10.1016/j.ejmech.2016.06.049 Glycogen phosphorylase, liver form 1

Data from ChEMBL 36 via Core Engine