Compound Detail
CHEMBL359307
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Basic Information
| ChEMBL ID | CHEMBL359307 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PFGPGGNXKZBICE-ARJAWSKDSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
299.3
MW (Da)
3.19
ALogP
5
HBA
1
HBD
62.9
PSA (Ų)
0.69
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MCF7 CHEMBL387 | IC50 | 5.51 | 5.51 | 3100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MCF7 | IC50 | = | 3100.0 | nM | 5.51 | Inhibitory activity against tubulin (1.0 mg/mL) assembly was determined | 12570374 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12570374 | 10.1021/jm020204l | Unchecked | 5 |
| 12570374 | 10.1021/jm020204l | MCF7 | 3 |
| 12570374 | 10.1021/jm020204l | Tubulin alpha chain | 2 |
| 12570374 | 10.1021/jm020204l | P388 | 1 |
| 16124759 | 10.1021/np058033l | P388 | 1 |
| 16124759 | 10.1021/np058033l | SF-295 | 1 |
| 16124759 | 10.1021/np058033l | KM-20L2 | 1 |
| 16124759 | 10.1021/np058033l | BXPC-3 | 1 |
| 16124759 | 10.1021/np058033l | DU-145 | 1 |
| 16124759 | 10.1021/np058033l | NCI-H460 | 1 |
| 16124759 | 10.1021/np058033l | MCF7 | 1 |
Data from ChEMBL 36 via Core Engine