Compound Detail
CHEMBL400150
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Basic Information
| ChEMBL ID | CHEMBL400150 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KVUAPEFTMWIOFW-UXBLZVDNSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
309.8
MW (Da)
4.76
ALogP
2
HBA
1
HBD
50.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.81
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| P388 CHEMBL389 | IC50 | 4.81 | 4.81 | 15330.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| P388 | IC50 | = | 15330.0 | nM | 4.81 | Antiproliferative activity against mouse P388 cells by MTT assay | 17904844 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17904844 | 10.1016/j.bmcl.2007.09.040 | P388 | 1 |
| 17904844 | 10.1016/j.bmcl.2007.09.040 | SK-N-MC | 1 |
| 17904844 | 10.1016/j.bmcl.2007.09.040 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine