Compound Detail
CHEMBL1162345
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Basic Information
| ChEMBL ID | CHEMBL1162345 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XCSSSGMWRCNFBK-RSKRUZOQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
408.5
MW (Da)
2.57
ALogP
5
HBA
4
HBD
125.5
PSA (Ų)
0.30
QED
0
Ro5 Violations
4
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 | 1480.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 1480.0 | nM | 5.83 | Displacement of [3H]histamine from human histamine H4 receptor expressed in SK-N... | 18459760 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18459760 | 10.1021/jm7014777 | Histamine H4 receptor | 2 |
Data from ChEMBL 36 via Core Engine