Compound Detail
CHEMBL406345
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Basic Information
| ChEMBL ID | CHEMBL406345 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XYPHSYGSRMVMNJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
278.7
MW (Da)
2.04
ALogP
4
HBA
2
HBD
61.0
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 5.83 | 5.83 | 1479.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 1479.11 | nM | 5.83 | Displacement of [3H]histamine from human histamine H4 receptor expressed in HEK2... | 18357976 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18357976 | 10.1021/jm7014217 | Histamine H4 receptor | 1 |
Data from ChEMBL 36 via Core Engine