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

CHEMBL1641746

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
CCCCCCCCC[C@@H]1N[C@@H](CO)[C@H](O)[C@H]1O

Basic Information

ChEMBL ID CHEMBL1641746
Phase Preclinical
Structure Type MOL
InChI Key DRNPXCOTCYRPEY-XUXIUFHCSA-N
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

259.4
MW (Da)
1.18
ALogP
4
HBA
4
HBD
72.7
PSA (Ų)
0.47
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H29NO3
MW 259.39
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 1.68

Activity Summary

IC50 6 meas. best 6.08

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Acidic alpha-glucosidase
CHEMBL3513
IC50 6.08 6.08 840.0 2
Sucrase-isomaltase, intestinal
CHEMBL3114
IC50 5.85 5.85 1400.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21185187 10.1016/j.bmcl.2010.11.112 Sucrase-isomaltase, intestinal 2
23106358 10.1021/jm301304e Sucrase-isomaltase, intestinal 2
21185187 10.1016/j.bmcl.2010.11.112 Acidic alpha-glucosidase 1
21185187 10.1016/j.bmcl.2010.11.112 Unchecked 1
21185187 10.1016/j.bmcl.2010.11.112 Lactase/phlorizin hydrolase 1
23106358 10.1021/jm301304e Acidic alpha-glucosidase 1

Data from ChEMBL 36 via Core Engine