Compound Detail
CHEMBL5794552
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Basic Information
| ChEMBL ID | CHEMBL5794552 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YBQUWVFHSNRTQF-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
295.8
MW (Da)
3.68
ALogP
2
HBA
1
HBD
31.9
PSA (Ų)
0.55
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Microtubule-associated protein tau CHEMBL1293224 | Ki | 7.6 | 7.6 | 25.1 | 1 |
| Alpha-synuclein CHEMBL6152 | Ki | 7.3 | 7.3 | 49.9 | 1 |
| Unchecked CHEMBL612545 | Ki | 6.04 | 6.04 | 909.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Microtubule-associated protein tau | Ki | = | 25.1 | nM | 7.6 | In Vitro Inhibition Assay: Table 5: Fresh solutions of the test compounds (2.5 m... | - |
| Alpha-synuclein | Ki | = | 49.9 | nM | 7.3 | In Vitro Inhibition Assay: Table 5: Fresh solutions of the test compounds (2.5 m... | - |
| Unchecked | Ki | = | 909.0 | nM | 6.04 | In Vitro Inhibition Assay: Table 5: Fresh solutions of the test compounds (2.5 m... | - |
Data from ChEMBL 36 via Core Engine