Compound Detail
CHEMBL466673
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Basic Information
| ChEMBL ID | CHEMBL466673 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VZDZEVPLKBVYAB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
353.8
MW (Da)
4.29
ALogP
3
HBA
2
HBD
77.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.79 | 5.79 | 1610.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1640.0 | nM | 5.79 | Inhibition of tubulin polymerization | 19394222 |
| Unchecked | IC50 | = | 1610.0 | nM | 5.79 | Displacement of [3H]colchicine from tubulin | 19394222 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19394222 | 10.1016/j.bmcl.2009.04.010 | Unchecked | 4 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | Molecular identity unknown | 2 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | Leukemia cell | 2 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | K562 | 1 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | PC-3 | 1 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | MCF7 | 1 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | SW-620 | 1 |
| 19394222 | 10.1016/j.bmcl.2009.04.010 | HT-29 | 1 |
Data from ChEMBL 36 via Core Engine