Compound Detail
CHEMBL5943183
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Basic Information
| ChEMBL ID | CHEMBL5943183 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WMUDEMBOOGSKRP-SOLBZPMBSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
333.5
MW (Da)
3.28
ALogP
4
HBA
1
HBD
41.9
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 8.59 | 8.59 | 2.6 | 1 |
| Synaptic vesicular amine transporter CHEMBL1893 | Ki | 8.28 | 8.28 | 5.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 2.6 | nM | 8.59 | Determining Vmat2 Inhibitory Activity of a Compound: Examples of techniques for ... | - |
| Synaptic vesicular amine transporter | Ki | = | 5.2 | nM | 8.28 | Determining Vmat2 Inhibitory Activity of a Compound: Examples of techniques for ... | - |
Data from ChEMBL 36 via Core Engine