Compound Detail
CHEMBL5595312
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 | CHEMBL5595312 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DPCUNIIUTMKIKJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
461.4
MW (Da)
4.04
ALogP
8
HBA
2
HBD
96.8
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDK12/Cyclin K CHEMBL4106169 | EC50 | 8.05 | 8.05 | 9.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDK12/Cyclin K | EC50 | = | 9.0 | nM | 8.05 | Inhibition of 6His-tagged wild type CDK12/cyclin K (unknown origin) infected in ... | 38852339 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38852339 | 10.1016/j.ejmech.2024.116547 | CDK12/Cyclin K | 1 |
Data from ChEMBL 36 via Core Engine