Compound Detail
CHEMBL3633244
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Basic Information
| ChEMBL ID | CHEMBL3633244 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WWPOCAWNOMBBCD-NUTKFTJISA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
339.4
MW (Da)
1.82
ALogP
6
HBA
1
HBD
85.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| A549 CHEMBL392 | EC50 | 4.31 | 4.31 | 49000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| A549 | EC50 | = | 49000.0 | nM | 4.31 | Cytotoxicity against human A549 cells assessed as decrease in cell viability at ... | 26508550 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26508550 | 10.1016/j.bmcl.2015.10.048 | A549 | 4 |
Data from ChEMBL 36 via Core Engine