Compound Detail
CHEMBL56846
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Basic Information
| ChEMBL ID | CHEMBL56846 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LKFGYSASEUQZFU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
408.5
MW (Da)
5.38
ALogP
5
HBA
2
HBD
75.5
PSA (Ų)
0.39
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| FM3A CHEMBL614297 | IC50 | 8.0 | 8.0 | 10.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| FM3A | IC50 | = | 10.0 | nM | 8.0 | Inhibit growth of FM3A cells by 50% | 1732542 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3116257 | 10.1021/jm00393a035 | Mus musculus | 3 |
| 1732542 | 10.1021/jm00080a010 | P388 | 3 |
| 1732542 | 10.1021/jm00080a010 | FM3A | 2 |
| 3116257 | 10.1021/jm00393a035 | ADMET | 1 |
| 1732542 | 10.1021/jm00080a010 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine