Compound Detail
CHEMBL346817
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Basic Information
| ChEMBL ID | CHEMBL346817 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | INXUWDAPOGPMQO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
244.7
MW (Da)
2.75
ALogP
4
HBA
0
HBD
43.1
PSA (Ų)
0.66
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| GABA-A receptor; anion channel CHEMBL1907607 | IC50 | 6.15 | 6.15 | 709.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| GABA-A receptor; anion channel | IC50 | = | 709.0 | nM | 6.15 | In vitro for inhibition of [3H]diazepam towards Benzodiazepine receptor from rat | 6113284 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6113284 | 10.1021/jm00137a020 | GABA-A receptor; anion channel | 3 |
| 6113284 | 10.1021/jm00137a020 | Rattus norvegicus | 2 |
Data from ChEMBL 36 via Core Engine