Compound Detail
CHEMBL1351967
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Basic Information
| ChEMBL ID | CHEMBL1351967 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UIGTVENTGQKXHV-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1617564 |
| Active Moiety | CHEMBL1617564 |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
391.5
MW (Da)
5.04
ALogP
4
HBA
1
HBD
32.0
PSA (Ų)
0.48
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.75
IC50 1 meas. best 5.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 35 CHEMBL1293267 | IC50 | 5.88 | 5.88 | 1327.8 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.75 | 4.75 | 17762.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 35 | IC50 | = | 1327.82 | nM | 5.88 | PUBCHEM_BIOASSAY: Image-Based HTS for Selective Antagonists of GPR35. High conte... | - |
| Unchecked | EC50 | = | 17762.0 | nM | 4.75 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Activato... | - |
Data from ChEMBL 36 via Core Engine