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Compound Detail

CHEMBL60162

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CC1SC(O)C(O)C(O)C1O

Basic Information

ChEMBL ID CHEMBL60162
Phase Preclinical
Structure Type MOL
InChI Key QVIFEFBNURQVKR-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

180.2
MW (Da)
-1.48
ALogP
5
HBA
4
HBD
80.9
PSA (Ų)
0.37
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 C6H12O4S
MW 180.22
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 1.04

Activity Summary

Ki 2 meas. best 4.38

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tissue alpha-L-fucosidase
CHEMBL4176
Ki 4.38 4.24 42000.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80649-6 Tissue alpha-L-fucosidase 1
- 10.1016/0960-894X(96)00356-3 Tissue alpha-L-fucosidase 1

Data from ChEMBL 36 via Core Engine