Compound Detail
CHEMBL459937
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Basic Information
| ChEMBL ID | CHEMBL459937 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WKTSRPYICDVYET-ONEGZZNKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
296.3
MW (Da)
4.33
ALogP
4
HBA
1
HBD
51.8
PSA (Ų)
0.73
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.21 | 8.21 | 6.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 6.2 | nM | 8.21 | Displacement of [3H]colchicine from tubulin by scintillation proximity assay | 18783207 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18783207 | 10.1021/jm8005004 | Unchecked | 2 |
| 18783207 | 10.1021/jm8005004 | BMEC | 1 |
Data from ChEMBL 36 via Core Engine