Compound Detail
CHEMBL3215673
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Basic Information
| ChEMBL ID | CHEMBL3215673 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QWTBVGJFTKMIRR-UHFFFAOYSA-N |
| Parent Compound | CHEMBL2079121 |
| Active Moiety | CHEMBL2079121 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
406.5
MW (Da)
4.94
ALogP
4
HBA
4
HBD
97.5
PSA (Ų)
0.27
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L6 CHEMBL614793 | IC50 | 4.03 | 4.03 | 93500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L6 | IC50 | = | 93500.0 | nM | 4.03 | Cytotoxicity against rat L6 cells | 22840696 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22840696 | 10.1016/j.ejmech.2012.06.058 | Nucleic Acid | 1 |
| 22840696 | 10.1016/j.ejmech.2012.06.058 | L6 | 1 |
| 22840696 | 10.1016/j.ejmech.2012.06.058 | Leishmania donovani | 1 |
| 22840696 | 10.1016/j.ejmech.2012.06.058 | Leishmania amazonensis | 1 |
Data from ChEMBL 36 via Core Engine