Compound Detail
CHEMBL2402883
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Basic Information
| ChEMBL ID | CHEMBL2402883 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GCTGFAIFLFDAGY-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
281.3
MW (Da)
3.29
ALogP
4
HBA
0
HBD
73.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.62
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | IC50 | = | 2400.0 | nM | 5.62 | Cytotoxicity against human HL60 cells after 46 hrs by MTT assay | 23756061 |
| NALM-6 | IC50 | = | 5000.0 | nM | 5.3 | Cytotoxicity against human NALM6 cells after 46 hrs by MTT assay | 23756061 |
| HUVEC | IC50 | = | 5400.0 | nM | 5.27 | Cytotoxicity against HUVEC after 46 hrs by MTT assay | 23756061 |
| WM-115 | IC50 | = | 6100.0 | nM | 5.21 | Cytotoxicity against human WM115 cells after 46 hrs by MTT assay | 23756061 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23756061 | 10.1016/j.bmcl.2013.05.044 | WM-115 | 1 |
| 23756061 | 10.1016/j.bmcl.2013.05.044 | HUVEC | 1 |
| 23756061 | 10.1016/j.bmcl.2013.05.044 | NALM-6 | 1 |
| 23756061 | 10.1016/j.bmcl.2013.05.044 | No relevant target | 1 |
| 23756061 | 10.1016/j.bmcl.2013.05.044 | HL-60 | 1 |
Data from ChEMBL 36 via Core Engine