Compound Detail
CHEMBL351489
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Basic Information
| ChEMBL ID | CHEMBL351489 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GFBCCYAUTYOZMC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
404.1
MW (Da)
-2.45
ALogP
8
HBA
8
HBD
240.7
PSA (Ų)
0.21
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Type 1 InsP3 receptor isoform S2 CHEMBL2950 | IC50 | 5.82 | 5.82 | 1500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Type 1 InsP3 receptor isoform S2 | IC50 | = | 1500.0 | nM | 5.82 | Binding affinity of compound was determined by its ability to displace specifica... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00120-I | Type 1 InsP3 receptor isoform S2 | 1 |
Data from ChEMBL 36 via Core Engine