Compound Detail
CHEMBL256283
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Basic Information
| ChEMBL ID | CHEMBL256283 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FSCKTUVAGKDDRN-WAYWQWQTSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
360.4
MW (Da)
3.38
ALogP
7
HBA
1
HBD
106.1
PSA (Ų)
0.35
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.51 | 4.51 | 31000.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.42 | 4.42 | 37700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 31000.0 | nM | 4.51 | Inhibition of calf tubulin polymerization | 18303849 |
| NON-PROTEIN TARGET | IC50 | = | 37700.0 | nM | 4.42 | Cytotoxicity against mouse MHEC5-T cells after 1 hr by MTT assay | 18303849 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18303849 | 10.1021/np070377j | Mus musculus | 2 |
| 18303849 | 10.1021/np070377j | NON-PROTEIN TARGET | 2 |
| 18303849 | 10.1021/np070377j | Unchecked | 1 |
| 18303849 | 10.1021/np070377j | BXPC-3 | 1 |
| 18303849 | 10.1021/np070377j | MCF7 | 1 |
| 18303849 | 10.1021/np070377j | SF-268 | 1 |
| 18303849 | 10.1021/np070377j | NCI-H460 | 1 |
| 18303849 | 10.1021/np070377j | KM-20L2 | 1 |
| 18303849 | 10.1021/np070377j | DU-145 | 1 |
Data from ChEMBL 36 via Core Engine