Compound Detail
CHEMBL5770629
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Basic Information
| ChEMBL ID | CHEMBL5770629 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HMNJLWJEBCAECR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
389.8
MW (Da)
2.13
ALogP
6
HBA
3
HBD
112.8
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase 5 CHEMBL5285 | IC50 | 8.8 | 8.615 | 1.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase 5 | IC50 | = | 1.58 | nM | 8.8 | ASK1/2 Biochemical Assays (AlphaScreen Technology) : ASK1 and ASK2 biochemical a... | - |
| Mitogen-activated protein kinase kinase kinase 5 | IC50 | = | 3.72 | nM | 8.43 | ASK1/2 Biochemical Assays (IMAP Technology): IMAP technology provides a homogene... | - |
Data from ChEMBL 36 via Core Engine