Compound Detail
CHEMBL1709632
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1709632 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IOTJXEMRQZVVKK-CIAFOILYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
413.9
MW (Da)
3.63
ALogP
6
HBA
2
HBD
80.5
PSA (Ų)
0.29
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 35 CHEMBL1293267 | IC50 | 6.68 | 5.67 | 211.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 35 | IC50 | = | 211.0 | nM | 6.68 | PUBCHEM_BIOASSAY: SAR analysis of Antagonists of the GPR35 Receptor using an Ima... | - |
| G-protein coupled receptor 35 | IC50 | = | 21800.0 | nM | 4.66 | PUBCHEM_BIOASSAY: SAR Analysis for the identification of Selective Antagonists o... | - |
Data from ChEMBL 36 via Core Engine