Compound Detail
CHEMBL357071
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Basic Information
| ChEMBL ID | CHEMBL357071 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JUQCQMDYTOHMCS-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
318.4
MW (Da)
3.46
ALogP
5
HBA
0
HBD
44.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Ki 1 meas. best 4.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
| Tubulin alpha chain CHEMBL3658 | Ki | 4.66 | 4.66 | 22000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 7000.0 | nM | 5.16 | Concentration was evaluated for its ability to inhibit microtubule assembly and ... | - |
| Tubulin alpha chain | Ki | = | 22000.0 | nM | 4.66 | Compound was evaluated for its ability to inhibit the binding of [3H]-colchicine... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24881570 | 10.1016/j.bmcl.2014.05.007 | NON-PROTEIN TARGET | 2 |
| - | 10.1016/S0960-894X(01)81108-2 | Unchecked | 1 |
| - | 10.1016/S0960-894X(01)81108-2 | Tubulin alpha chain | 1 |
Data from ChEMBL 36 via Core Engine