Compound Detail
CHEMBL392652
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Basic Information
| ChEMBL ID | CHEMBL392652 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QQUWFXMXRVAVCX-XDHOZWIPSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
290.3
MW (Da)
3.31
ALogP
3
HBA
2
HBD
61.7
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SK-N-MC CHEMBL614163 | IC50 | 6.0 | 6.0 | 990.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SK-N-MC | IC50 | = | 990.0 | nM | 6.0 | Antiproliferative activity against human SK-N-MC cells by MTT assay | 17963372 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17963372 | 10.1021/jm070839q | SK-N-MC | 1 |
| 22361685 | 10.1016/j.ejmech.2012.01.056 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 24360560 | 10.1016/j.bmcl.2013.12.015 | Clostridioides difficile | 1 |
Data from ChEMBL 36 via Core Engine