Compound Detail
CHEMBL346663
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Basic Information
| ChEMBL ID | CHEMBL346663 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YLQAJRDUWMLQST-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
316.4
MW (Da)
4.17
ALogP
3
HBA
0
HBD
25.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL1907607 | Ki | 4.95 | 4.95 | 11200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | Ki | = | 11200.0 | nM | 4.95 | In vitro inhibition of [3H]diazepam binding to rat cerebral cortical membrane be... | 6325688 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26681509 | 10.1016/j.bmcl.2015.11.070 | Ralstonia solanacearum | 2 |
| 6325688 | 10.1021/jm00371a002 | GABA-A receptor; anion channel | 1 |
| 26681509 | 10.1016/j.bmcl.2015.11.070 | Bacillus cereus | 1 |
| 26681509 | 10.1016/j.bmcl.2015.11.070 | Staphylococcus aureus | 1 |
Data from ChEMBL 36 via Core Engine