Compound Detail
CHEMBL410082
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Basic Information
| ChEMBL ID | CHEMBL410082 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSSFHYHDIOGBMU-GFOCRRMGSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
388.4
MW (Da)
0.87
ALogP
9
HBA
3
HBD
113.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.33
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CCRF-CEM | IC50 | = | 4650.0 | nM | 5.33 | Cytostatic activity in human CCRF-CEM cells assessed as inhibition of cell growt... | 18078757 |
| CCRF-CEM | IC50 | = | 9200.0 | nM | 5.04 | Cytostatic activity in human CCRF-CEM cells assessed as inhibition of cell growt... | 18078757 |
| HL-60 | IC50 | = | 10700.0 | nM | 4.97 | Cytostatic activity in human HL60 cells assessed as inhibition of cell growth af... | 18078757 |
| HL-60 | IC50 | = | 19200.0 | nM | 4.72 | Cytostatic activity in human HL60 cells assessed as inhibition of cell growth af... | 18078757 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18078757 | 10.1016/j.bmc.2007.11.067 | HL-60 | 6 |
| 18078757 | 10.1016/j.bmc.2007.11.067 | CCRF-CEM | 2 |
| 18078757 | 10.1016/j.bmc.2007.11.067 | L1210 | 1 |
| 18078757 | 10.1016/j.bmc.2007.11.067 | Hepatitis C virus | 1 |
| 18078757 | 10.1016/j.bmc.2007.11.067 | NON-PROTEIN TARGET | 1 |
| 18078757 | 10.1016/j.bmc.2007.11.067 | HeLa | 1 |
Data from ChEMBL 36 via Core Engine