Compound Detail
CHEMBL18554
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Basic Information
| ChEMBL ID | CHEMBL18554 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DHUWQDDHNRXGHO-AVGNSLFASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
270.3
MW (Da)
0.95
ALogP
3
HBA
3
HBD
83.8
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL4124 | Ki | 7.7 | 7.7 | 19.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 19.95 | nM | 7.7 | Binding affinity of compound against Histamine H3 receptor | 10197963 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10197963 | 10.1021/jm980408v | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine