Compound Detail
CHEMBL3354811
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Basic Information
| ChEMBL ID | CHEMBL3354811 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NCSPHUIPPNRUEE-SSDOTTSWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
275.3
MW (Da)
0.96
ALogP
5
HBA
2
HBD
67.1
PSA (Ų)
0.86
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 7.96 | 7.96 | 11.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 11.0 | nM | 7.96 | Displacement of [3H]histamine from human recombinant histamine H4 receptor | 25455490 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25455490 | 10.1016/j.bmcl.2014.10.013 | Histamine H4 receptor | 1 |
| 25455490 | 10.1016/j.bmcl.2014.10.013 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine