Compound Detail
CHEMBL341087
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Basic Information
| ChEMBL ID | CHEMBL341087 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNVQQKFVQDIMFD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
243.3
MW (Da)
1.60
ALogP
2
HBA
2
HBD
48.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H4 receptor CHEMBL3759 | Ki | 6.7 | 6.7 | 202.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 8.0 | mL.min-1.g-1 | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H4 receptor | Ki | = | 202.0 | nM | 6.7 | Displacement of [3H]- histamine from the recombinant human histamine H4 receptor | 12954048 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12954048 | 10.1021/jm0341047 | Histamine H4 receptor | 1 |
| - | 10.6019/CHEMBL3301361 | ADMET | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine