Compound Detail
CHEMBL173917
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Basic Information
| ChEMBL ID | CHEMBL173917 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KBBZNLDODYRECD-UHFFFAOYSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
264.3
MW (Da)
-1.09
ALogP
7
HBA
4
HBD
140.8
PSA (Ų)
0.29
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas.
Ki 1 meas. best 4.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| cAMP-dependent protein kinase A CHEMBL2111446 | Ki | 4.54 | 4.54 | 29000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| cAMP-dependent protein kinase A | Ki | = | 29000.0 | nM | 4.54 | Inhibitory constant for Protein Kinase A | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00140-0 | cAMP-dependent protein kinase A | 4 |
Data from ChEMBL 36 via Core Engine