Compound Detail
CHEMBL3937779
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Basic Information
| ChEMBL ID | CHEMBL3937779 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BYONSHWNDCZJFZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
395.4
MW (Da)
4.69
ALogP
7
HBA
0
HBD
105.0
PSA (Ų)
0.18
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 8.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily A member 3 CHEMBL4633 | EC50 | 8.15 | 8.15 | 7.0 | 1 |
| Potassium voltage-gated channel subfamily A member 5 CHEMBL4306 | EC50 | 6.98 | 6.98 | 105.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily A member 3 | EC50 | = | 7.0 | nM | 8.15 | Inhibition of Kv1.3 (unknown origin) | - |
| Potassium voltage-gated channel subfamily A member 5 | EC50 | = | 105.0 | nM | 6.98 | Inhibition of Kv1.5 (unknown origin) | - |
Data from ChEMBL 36 via Core Engine