Compound Detail
CHEMBL3233384
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Basic Information
| ChEMBL ID | CHEMBL3233384 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SWOOLGGRJYZVMR-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
349.4
MW (Da)
3.55
ALogP
6
HBA
2
HBD
99.0
PSA (Ų)
0.33
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.0
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HCT-116 | IC50 | = | 10.0 | nM | 8.0 | Cytotoxicity against human HCT116 cells assessed as cell viability after 72 hrs ... | 24686018 |
| MV4-11 | IC50 | = | 50.0 | nM | 7.3 | Cytotoxicity against human MV4-11 cells assessed as cell viability after 72 hrs ... | 24686018 |
| BALB/3T3 | IC50 | = | 80.0 | nM | 7.1 | Cytotoxicity against mouse BALB/3T3 cells assessed as cell viability after 72 hr... | 24686018 |
| A549 | IC50 | = | 110.0 | nM | 6.96 | Cytotoxicity against human A549 cells assessed as cell viability after 72 hrs by... | 24686018 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24686018 | 10.1016/j.ejmech.2014.03.038 | MV4-11 | 1 |
| 24686018 | 10.1016/j.ejmech.2014.03.038 | BALB/3T3 | 1 |
| 24686018 | 10.1016/j.ejmech.2014.03.038 | A549 | 1 |
| 24686018 | 10.1016/j.ejmech.2014.03.038 | HCT-116 | 1 |
Data from ChEMBL 36 via Core Engine