Compound Detail
CHEMBL2430215
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL2430215 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GYLNNZSOTKUCRO-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
446.2
MW (Da)
7.11
ALogP
0
HBA
2
HBD
31.6
PSA (Ų)
0.34
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.44
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MCF7 | IC50 | = | 3600.0 | nM | 5.44 | Cytotoxicity against human MCF7 cells assessed as growth inhibition after 48 hrs... | - |
| HeLa | IC50 | = | 3900.0 | nM | 5.41 | Cytotoxicity against human HeLa cells assessed as growth inhibition after 48 hrs... | - |
| A549 | IC50 | = | 6500.0 | nM | 5.19 | Cytotoxicity against human A549 cells assessed as growth inhibition after 48 hrs... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1007/s00044-013-0764-4 | Staphylococcus aureus | 2 |
| - | 10.1007/s00044-013-0764-4 | Pseudomonas aeruginosa | 1 |
| - | 10.1007/s00044-013-0764-4 | Escherichia coli | 1 |
| - | 10.1007/s00044-013-0764-4 | Enterococcus faecalis | 1 |
| - | 10.1039/C2MD20098H | MCF7 | 1 |
| - | 10.1039/C2MD20098H | HeLa | 1 |
| - | 10.1039/C2MD20098H | A549 | 1 |
Data from ChEMBL 36 via Core Engine