Compound Detail
CHEMBL403246
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 | CHEMBL403246 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SKCOTSHSZHCKEH-IPKBDRFQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
400.4
MW (Da)
4.77
ALogP
7
HBA
0
HBD
98.0
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.55 | 5.55 | 2800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2800.0 | nM | 5.55 | Inhibition of tubulin polymerization after 20 mins | 18083556 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18083556 | 10.1016/j.bmcl.2007.11.114 | Unchecked | 2 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | Human immunodeficiency virus 1 | 2 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | Human immunodeficiency virus 2 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | CEM-SS | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | MT4 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | HOP-62 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | HCT-116 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | SF-539 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | LOX IMVI | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | NON-PROTEIN TARGET | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | SN12C | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | DU-145 | 1 |
| 18083556 | 10.1016/j.bmcl.2007.11.114 | MDA-MB-435 | 1 |
Data from ChEMBL 36 via Core Engine