Compound Detail
CHEMBL4644318
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Basic Information
| ChEMBL ID | CHEMBL4644318 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DWBPCKNPUQQHND-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
364.2
MW (Da)
3.99
ALogP
3
HBA
1
HBD
55.4
PSA (Ų)
0.66
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adenylate cyclase type 8 CHEMBL2960 | EC50 | 6.98 | 6.98 | 105.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adenylate cyclase type 8 | EC50 | = | 105.2 | nM | 6.98 | Agonist activity at recombinant human AC8 expressed in human HEK293 cells assess... | 31776060 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31776060 | 10.1016/j.bmcl.2019.126823 | Adenylate cyclase type 8 | 3 |
| 31776060 | 10.1016/j.bmcl.2019.126823 | Adenylate cyclase type 1 | 1 |
| 31776060 | 10.1016/j.bmcl.2019.126823 | Adenylate cyclase type 2 | 1 |
| 31776060 | 10.1016/j.bmcl.2019.126823 | Adenylate cyclase type 5 | 1 |
| 32105982 | 10.1016/j.ejmech.2020.112115 | Adenylate cyclase type 8 | 1 |
Data from ChEMBL 36 via Core Engine