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

CHEMBL165084

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
CC(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)O)C[C@@H]1O

Basic Information

ChEMBL ID CHEMBL165084
Phase Preclinical
Structure Type MOL
InChI Key SQVRNKJHWKZAKO-PFQGKNLYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names

Molecular Properties

309.3
MW (Da)
-3.87
ALogP
8
HBA
7
HBD
176.8
PSA (Ų)
0.27
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C11H19NO9
MW 309.27
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness 1.57

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
9526556 10.1021/jm9703754 Neuraminidase 2
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
23747226 10.1016/j.bmcl.2013.05.052 No relevant target 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
35170942 10.1021/acs.jmedchem.1c01612 Sialidase-1 1
35170942 10.1021/acs.jmedchem.1c01612 Sialidase-2 1
35170942 10.1021/acs.jmedchem.1c01612 Sialidase-3 1
35170942 10.1021/acs.jmedchem.1c01612 Sialidase-4 1

Data from ChEMBL 36 via Core Engine