Compound Detail
CHEMBL142540
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Basic Information
| ChEMBL ID | CHEMBL142540 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KTEAUWXRWMZUIG-YPVSKDHRSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
336.1
MW (Da)
-0.16
ALogP
8
HBA
4
HBD
116.8
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L5178Y CHEMBL614720 | IC50 | 6.01 | 5.805 | 980.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L5178Y | IC50 | = | 980.0 | nM | 6.01 | In vitro growth inhibition of L5178Y-Parental murine leukemia cells | 11101356 |
| L5178Y | IC50 | = | 2500.0 | nM | 5.6 | In vitro growth inhibition of FdUrd resistant L5178Y-Resistant murine leukemia c... | 11101356 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11101356 | 10.1021/jm000975u | L5178Y | 2 |
Data from ChEMBL 36 via Core Engine