Compound Detail
CHEMBL5979320
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 | CHEMBL5979320 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VPSSWMQTWXUJOQ-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
506.4
MW (Da)
4.13
ALogP
6
HBA
0
HBD
63.0
PSA (Ų)
0.41
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium channel subfamily K member 9 CHEMBL2321614 | IC50 | 8.64 | 8.195 | 2.3 | 2 |
| Potassium channel subfamily K member 3 CHEMBL2321613 | IC50 | 8.31 | 7.58 | 4.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium channel subfamily K member 9 | IC50 | = | 2.3 | nM | 8.64 | Inhibition In Vito Assay: The investigations on the inhibition of the recombinan... | - |
| Potassium channel subfamily K member 3 | IC50 | = | 4.9 | nM | 8.31 | Inhibition In Vito Assay: The investigations on the inhibition of the recombinan... | - |
| Potassium channel subfamily K member 9 | IC50 | = | 18.0 | nM | 7.75 | Inhibition In Vito Assay: The investigations on the inhibition of the recombinan... | - |
| Potassium channel subfamily K member 3 | IC50 | = | 140.0 | nM | 6.85 | Inhibition In Vito Assay: The investigations on the inhibition of the recombinan... | - |
Data from ChEMBL 36 via Core Engine