Compound Detail
CHEMBL210783
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Basic Information
| ChEMBL ID | CHEMBL210783 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RRNVRBJCISDRTQ-NRFANRHFSA-N |
1
Targets
1
Activities
1
Assay Types
5
PK Parameters
2
Publications
0
Known Names
Molecular Properties
428.9
MW (Da)
5.38
ALogP
4
HBA
2
HBD
76.8
PSA (Ų)
0.36
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAC-alpha serine/threonine-protein kinase CHEMBL4282 | IC50 | 6.39 | 6.39 | 407.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 910.0 | ng.hr.mL-1 | Mus musculus |
| AUC | - | - | Mus musculus |
| CL | 5.4 | L/hr | Mus musculus |
| F | 27.0 | % | Mus musculus |
| T1/2 | 2.0 | hr | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAC-alpha serine/threonine-protein kinase | IC50 | = | 407.0 | nM | 6.39 | Inhibition of Akt1 at 5 uM ATP | 16603355 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16603355 | 10.1016/j.bmcl.2006.03.041 | Mus musculus | 6 |
| 16603355 | 10.1016/j.bmcl.2006.03.041 | RAC-alpha serine/threonine-protein kinase | 1 |
Data from ChEMBL 36 via Core Engine