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

CHEMBL13924

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
O[C@H]1[C@H](O)[C@H](O)CNC[C@H]1O

Basic Information

ChEMBL ID CHEMBL13924
Phase Preclinical
Structure Type MOL
InChI Key MRFFNLOQLBWKPJ-KVTDHHQDSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

163.2
MW (Da)
-2.97
ALogP
5
HBA
5
HBD
93.0
PSA (Ų)
0.26
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C6H13NO4
MW 163.17
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 1.15

Activity Summary

Ki 1 meas. best 5.34

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
Ki 5.34 5.34 4600.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked Ki = 4600.0 nM 5.34 Compound was tested for inhibition of beta-N-acetylglucosaminidase from jack bea... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(96)00183-7 Unchecked 2
- 10.1016/0960-894X(96)00183-7 Alpha-galactosidase A 1
- 10.1016/0960-894X(96)00183-7 Beta-galactosidase 1
- 10.1016/0960-894X(96)00183-7 Lysosomal alpha-glucosidase 1
- 10.1016/0960-894X(96)00183-7 Lysosomal acid glucosylceramidase 1
- 10.1016/0960-894X(96)00183-7 Tissue alpha-L-fucosidase 1

Data from ChEMBL 36 via Core Engine