Compound Detail
CHEMBL307395
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Basic Information
| ChEMBL ID | CHEMBL307395 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DPWVUEQXMOBVOQ-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
363.5
MW (Da)
5.65
ALogP
1
HBA
3
HBD
47.9
PSA (Ų)
0.32
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 6.1 | 6.1 | 800.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.95 | 5.95 | 1130.0 | 1 |
| Sodium channel protein type 2 subunit alpha CHEMBL4187 | IC50 | 5.69 | 5.69 | 2030.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 800.0 | nM | 6.1 | Compound was evaluated for the inhibition of K+ -evoked glutamate release throug... | - |
| Unchecked | IC50 | = | 1130.0 | nM | 5.95 | Inhibition of 45 [Ca2+] flux into rat brain synaptosomes depolarized by elevated... | - |
| Sodium channel protein type 2 subunit alpha | IC50 | = | 2030.0 | nM | 5.69 | Blockade of synaptosomal sodium channels, inhibition of [14C]guanidinium ion flu... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00392-7 | Rattus norvegicus | 1 |
| - | 10.1016/0960-894X(95)00392-7 | Sodium channel alpha subunits; brain (Types I, II, III) | 1 |
| - | 10.1016/0960-894X(95)00392-7 | Unchecked | 1 |
| - | 10.1016/0960-894X(95)00392-7 | Sodium channel protein type 2 subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine