Compound Detail
CHEMBL1724535
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Basic Information
| ChEMBL ID | CHEMBL1724535 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNUSJPTYXPMREL-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
322.8
MW (Da)
4.92
ALogP
4
HBA
1
HBD
59.1
PSA (Ų)
0.57
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 4.92 | 4.8725 | 11900.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 11900.0 | nM | 4.92 | PUBCHEM_BIOASSAY: Dose response counterscreen for uHTS small molecule activators... | - |
| Unchecked | EC50 | = | 12900.0 | nM | 4.89 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
| Unchecked | EC50 | = | 13700.0 | nM | 4.86 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
| Unchecked | EC50 | = | 15000.0 | nM | 4.82 | PUBCHEM_BIOASSAY: Dose response counterscreen of small molecule activators of th... | - |
Data from ChEMBL 36 via Core Engine