Compound Detail
CHEMBL1171848
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Basic Information
| ChEMBL ID | CHEMBL1171848 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LCUPINWVEJYXRG-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
328.4
MW (Da)
3.52
ALogP
5
HBA
0
HBD
54.0
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.37 | 6.185 | 430.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 430.0 | nM | 6.37 | Inhibition of calf brain tubulin by turbidimetry | 32432867 |
| Unchecked | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of tubulin polymerization | 20187635 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20187635 | 10.1021/np900821e | KB | 2 |
| 20187635 | 10.1021/np900821e | NON-PROTEIN TARGET | 2 |
| 20187635 | 10.1021/np900821e | Unchecked | 1 |
| 32432867 | 10.1021/acs.jmedchem.0c00222 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine