Compound Detail
CHEMBL4444841
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Basic Information
| ChEMBL ID | CHEMBL4444841 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AWBIGSFLJDIUHC-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
394.5
MW (Da)
3.80
ALogP
7
HBA
2
HBD
101.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase LATS1 CHEMBL6167 | IC50 | 6.79 | 6.79 | 163.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase LATS1 | IC50 | = | 163.9 | nM | 6.79 | Inhibition of human LATS1 kinase domain (589 to 1130 amino acids) incubated for ... | - |
| Serine/threonine-protein kinase LATS1 | IC50 | = | 164.0 | nM | 6.79 | LATS1 Biochemical Caliper Assay: The LATS1 biochemical Caliper assay was perform... | - |
Data from ChEMBL 36 via Core Engine