Compound Detail
CHEMBL1967184
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Basic Information
| ChEMBL ID | CHEMBL1967184 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QLOQYEFZVNOYEP-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
313.3
MW (Da)
2.07
ALogP
4
HBA
3
HBD
84.2
PSA (Ų)
0.59
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 4.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| H4 CHEMBL1075452 | EC50 | 4.66 | 4.66 | 21722.0 | 1 |
| Heat shock factor protein 1 CHEMBL5313 | EC50 | 4.44 | 4.44 | 36556.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.41 | 4.41 | 39240.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| H4 | EC50 | = | 21722.0 | nM | 4.66 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Activato... | - |
| Heat shock factor protein 1 | EC50 | = | 36556.0 | nM | 4.44 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhi... | - |
| Unchecked | EC50 | = | 39240.0 | nM | 4.41 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Activato... | - |
Data from ChEMBL 36 via Core Engine