Compound Detail
CHEMBL165084
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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 |
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