Compound Detail
CHEMBL185859
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Basic Information
| ChEMBL ID | CHEMBL185859 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNXWOWOQJDHXMT-NKFKGCMQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
436.6
MW (Da)
6.17
ALogP
5
HBA
1
HBD
72.8
PSA (Ų)
0.50
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 7.99 | 7.99 | 10.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 10.29 | nM | 7.99 | Displacement of [20-3H]-phorbol 12,13-dibutyrate (PDBU) from recombinant Protein... | 15267238 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15267238 | 10.1021/jm0497747 | No relevant target | 1 |
| 15267238 | 10.1021/jm0497747 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine