Compound Detail
CHEMBL3914004
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Basic Information
| ChEMBL ID | CHEMBL3914004 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NELWRUKPAAXJON-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
503.5
MW (Da)
4.83
ALogP
6
HBA
2
HBD
120.6
PSA (Ų)
0.39
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium channel protein type 10 subunit alpha CHEMBL4017 | IC50 | 7.89 | 7.89 | 13.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 7.89 | 7.89 | 13.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium channel protein type 10 subunit alpha | IC50 | = | 13.0 | nM | 7.89 | Electrophysiology Assay: Patch clamp electrophysiology was used to assess the ef... | - |
| Unchecked | IC50 | = | 13.0 | nM | 7.89 | Electrophysiology Assays: Patch clamp electrophysiology was used to assess the e... | - |
Data from ChEMBL 36 via Core Engine