Compound Detail
CHEMBL1314103
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Basic Information
| ChEMBL ID | CHEMBL1314103 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZTKRJYVFJUQHC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
346.4
MW (Da)
2.73
ALogP
4
HBA
1
HBD
68.3
PSA (Ų)
0.70
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycine receptor subunit alpha-3 CHEMBL1075092 | EC50 | 5.41 | 5.41 | 3900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycine receptor subunit alpha-3 | EC50 | = | 3900.0 | nM | 5.41 | Positive allosteric modulation of recombinant human glycine receptor alpha3 expr... | 28606760 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28606760 | 10.1016/j.bmcl.2017.04.073 | Glycine receptor subunit alpha-3 | 2 |
| 28606760 | 10.1016/j.bmcl.2017.04.073 | Glycine receptor subunit alpha-1 | 1 |
| 28606760 | 10.1016/j.bmcl.2017.04.073 | GABA-A receptor; alpha-1/beta-3/gamma-2 | 1 |
| 28606760 | 10.1016/j.bmcl.2017.04.073 | GABA-A receptor; alpha-2/beta-3/gamma-2 | 1 |
Data from ChEMBL 36 via Core Engine