Compound Detail
CHEMBL343881
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Basic Information
| ChEMBL ID | CHEMBL343881 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AJJOPVWRSMUEBL-YPVSKDHRSA-N |
1
Targets
6
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
291.7
MW (Da)
-0.27
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 6 meas. best 5.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L5178Y CHEMBL614720 | IC50 | 5.99 | 5.8283 | 1030.0 | 6 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L5178Y | IC50 | = | 1030.0 | nM | 5.99 | In vitro growth inhibition of FdUrd resistant L5178Y-Resistant murine leukemia c... | 11101356 |
| L5178Y | IC50 | = | 1150.0 | nM | 5.94 | In vitro growth inhibition of L5178Y-Parental murine leukemia cells | 11101356 |
| L5178Y | IC50 | = | 1240.0 | nM | 5.91 | In vitro growth inhibition of L5178Y-Parental murine leukemia cells by incorpora... | 11101356 |
| L5178Y | IC50 | = | 1480.0 | nM | 5.83 | In vitro growth inhibition of L5178Y-Parental murine leukemia cells by incorpora... | 11101356 |
| L5178Y | IC50 | = | 1660.0 | nM | 5.78 | In vitro growth inhibition of FdUrd resistant L5178Y-Resistant murine leukemia c... | 11101356 |
| L5178Y | IC50 | = | 3010.0 | nM | 5.52 | 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 | 6 |
Data from ChEMBL 36 via Core Engine