Compound Detail
CHEMBL503019
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Basic Information
| ChEMBL ID | CHEMBL503019 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VXPIZIGVMHOHCW-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1187450 |
| Active Moiety | CHEMBL1187450 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
352.6
MW (Da)
2.87
ALogP
5
HBA
0
HBD
39.7
PSA (Ų)
0.69
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 7.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL5076 | Kd | 7.02 | 7.02 | 95.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Kd | = | 95.5 | nM | 7.02 | Antagonist activity at histamine H3 receptor in guinea pig jejunum assessed as e... | 18990469 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18990469 | 10.1016/j.ejmech.2008.09.019 | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine