Compound Detail
CHEMBL129176
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
Basic Information
| ChEMBL ID | CHEMBL129176 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MUQZLHXNHLNLRH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
383.4
MW (Da)
3.54
ALogP
6
HBA
0
HBD
66.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tubulin alpha chain CHEMBL3658 | IC50 | 5.5 | 5.5 | 3200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tubulin alpha chain | IC50 | = | 3200.0 | nM | 5.5 | Inhibition of tubulin polymerization. (ITP) | 11689079 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11689079 | 10.1021/jm0101085 | K562 | 1 |
| 11689079 | 10.1021/jm0101085 | NCI-H226 | 1 |
| 11689079 | 10.1021/jm0101085 | HCT-116 | 1 |
| 11689079 | 10.1021/jm0101085 | OVCAR-3 | 1 |
| 11689079 | 10.1021/jm0101085 | RXF 393 | 1 |
| 11689079 | 10.1021/jm0101085 | SK-MEL-5 | 1 |
| 11689079 | 10.1021/jm0101085 | SF-268 | 1 |
| 11689079 | 10.1021/jm0101085 | SF-295 | 1 |
| 11689079 | 10.1021/jm0101085 | Unchecked | 1 |
| 11689079 | 10.1021/jm0101085 | Tubulin alpha chain | 1 |
Data from ChEMBL 36 via Core Engine