Compound Detail
CHEMBL5748918
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Basic Information
| ChEMBL ID | CHEMBL5748918 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WEFVBGXAFYLIIP-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
337.4
MW (Da)
3.14
ALogP
4
HBA
2
HBD
83.1
PSA (Ų)
0.75
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rho-associated protein kinase 2 CHEMBL2973 | IC50 | 7.64 | 7.64 | 22.9 | 1 |
| Rho-associated protein kinase 1 CHEMBL3231 | IC50 | 6.99 | 6.99 | 102.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rho-associated protein kinase 2 | IC50 | = | 22.9 | nM | 7.64 | ROCK1 and ROCK2 Kinase Inhibition Assays: The following assay protocol is for me... | - |
| Rho-associated protein kinase 1 | IC50 | = | 102.0 | nM | 6.99 | ROCK1 and ROCK2 Kinase Inhibition Assays: The following assay protocol is for me... | - |
| Rho-associated protein kinase 1 | IC50 | = | 102.0 | nM | 6.99 | ROCK1 and ROCK2 Kinase Inhibition Assays: The following assay protocol is for me... | - |
Data from ChEMBL 36 via Core Engine