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Compound Detail

CHEMBL5197630

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COc1ccc([C@]2(CO)NC[C@@H](O)[C@@H]2O)cc1

Basic Information

ChEMBL ID CHEMBL5197630
Phase Preclinical
Structure Type MOL
InChI Key ZIJKOKJAWVSURB-WOPDTQHZSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

239.3
MW (Da)
-0.79
ALogP
5
HBA
4
HBD
82.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H17NO4
MW 239.27
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.67

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
35255314 10.1016/j.ejmech.2022.114230 Unchecked 11
35255314 10.1016/j.ejmech.2022.114230 Acidic alpha-glucosidase 1
35255314 10.1016/j.ejmech.2022.114230 Sucrase-isomaltase, intestinal 1
35255314 10.1016/j.ejmech.2022.114230 Lysosomal alpha-glucosidase 1
35255314 10.1016/j.ejmech.2022.114230 Alpha-galactosidase 1
35255314 10.1016/j.ejmech.2022.114230 Alpha-mannosidase 1
35255314 10.1016/j.ejmech.2022.114230 Tissue alpha-L-fucosidase 1

Data from ChEMBL 36 via Core Engine