Compound Detail
CHEMBL569075
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Basic Information
| ChEMBL ID | CHEMBL569075 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BOFYIYHXHPBGAS-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
332.5
MW (Da)
3.26
ALogP
4
HBA
1
HBD
33.7
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Synaptic vesicular amine transporter CHEMBL4828 | Ki | 6.7 | 6.635 | 199.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Synaptic vesicular amine transporter | Ki | = | 199.0 | nM | 6.7 | Displacement of [125I]-iodovinyl-TBZ from VMAT2 in rat striatal membrane homogen... | 19632829 |
| Synaptic vesicular amine transporter | Ki | = | 269.0 | nM | 6.57 | Displacement of [3H]-DTBZ from VMAT2 in rat striatal membrane homogenates | 19632829 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19632829 | 10.1016/j.bmcl.2009.07.048 | Synaptic vesicular amine transporter | 2 |
Data from ChEMBL 36 via Core Engine