Compound Detail
CHEMBL4076263
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Basic Information
| ChEMBL ID | CHEMBL4076263 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XZNRAZLMKCLNRH-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
273.9
MW (Da)
2.87
ALogP
2
HBA
1
HBD
41.5
PSA (Ų)
0.73
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RPMI-8226 CHEMBL614882 | IC50 | 6.0 | 6.0 | 1000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RPMI-8226 | IC50 | = | 1000.0 | nM | 6.0 | Cytotoxicity against human RPMI8226 cells after 48 hrs by MTT assay | 28916338 |
| RPMI-8226 | IC50 | = | 1000.0 | nM | 6.0 | Cytotoxicity in human RPMI8226 cells incubated for 48 hrs by MTT assay | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28916338 | 10.1016/j.bmcl.2017.09.002 | MM1.S | 1 |
| 28916338 | 10.1016/j.bmcl.2017.09.002 | RPMI-8226 | 1 |
| 28916338 | 10.1016/j.bmcl.2017.09.002 | DEP domain-containing mTOR-interacting protein | 1 |
Data from ChEMBL 36 via Core Engine