Compound Detail
CHEMBL3980215
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Basic Information
| ChEMBL ID | CHEMBL3980215 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VCLVGUHOUGKURD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
307.4
MW (Da)
1.63
ALogP
4
HBA
1
HBD
44.8
PSA (Ų)
0.86
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ryanodine receptor 2 CHEMBL4403 | EC50 | 7.36 | 7.36 | 44.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ryanodine receptor 2 | EC50 | = | 44.0 | nM | 7.36 | Induction of FKBP12.6 re-binding to PKA-phosphorylated-RyR2 (unknown origin) aft... | - |
Data from ChEMBL 36 via Core Engine