Compound Detail
CHEMBL3912592
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Basic Information
| ChEMBL ID | CHEMBL3912592 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HOQOGZFFYHYEDO-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3990787 |
| Active Moiety | CHEMBL3990787 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
405.4
MW (Da)
4.21
ALogP
7
HBA
2
HBD
92.8
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 7.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Voltage-gated inwardly rectifying potassium channel KCNH3 CHEMBL2363017 | IC50 | 7.07 | 7.07 | 85.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Voltage-gated inwardly rectifying potassium channel KCNH3 | IC50 | = | 85.0 | nM | 7.07 | Inhibition of KCl-stimulated BEC1 (unknown origin) expressed in dihydrofolate re... | - |
Data from ChEMBL 36 via Core Engine