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Compound Detail

CHEMBL5432010

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COc1ccc(CCCCN2C[C@@H](O)[C@H](O)[C@H]2CO)cc1

Basic Information

ChEMBL ID CHEMBL5432010
Phase Preclinical
Structure Type MOL
InChI Key VZOBZZMYDUEVSV-BZUAXINKSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

295.4
MW (Da)
0.42
ALogP
5
HBA
3
HBD
73.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H25NO4
MW 295.38
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.72

Activity Summary

Ki 1 meas. best 5.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysosomal alpha-glucosidase
CHEMBL2608
Ki 5.24 5.24 5700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
37314161 10.1021/acs.jmedchem.3c00637 Lysosomal alpha-glucosidase 1

Data from ChEMBL 36 via Core Engine