Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL88408

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC21

Basic Information

ChEMBL ID CHEMBL88408
Phase Preclinical
Structure Type MOL
InChI Key WWMAKEJMUWTUCR-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

280.3
MW (Da)
-1.32
ALogP
7
HBA
5
HBD
114.5
PSA (Ų)
0.46
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 C13H16N2O5
MW 280.28
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.97

Activity Summary

IC50 2 meas. best 5.53

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysosomal alpha-glucosidase
CHEMBL2608
IC50 5.53 5.53 2930.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Lysosomal alpha-glucosidase IC50 = 2930.0 nM 5.53 Inhibitory activity was determined against baker's yeast Alpha-Glucosidase -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80688-0 Lysosomal alpha-glucosidase 2
- 10.1016/S0960-894X(01)80688-0 Lysosomal acid glucosylceramidase 2
- 10.1016/S0960-894X(01)80688-0 Alpha-glucosidase 1

Data from ChEMBL 36 via Core Engine