Compound Detail
CHEMBL2312412
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Basic Information
| ChEMBL ID | CHEMBL2312412 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YBTVFALKLXMBIT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
384.6
MW (Da)
4.24
ALogP
4
HBA
2
HBD
32.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.58 | 5.58 | 2600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2600.0 | nM | 5.58 | Inhibition of sheep dyn1 after 30 mins by malachite green GTPase assay in presen... | 23167654 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23167654 | 10.1021/jm300844m | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine