Compound Detail
CHEMBL4865309
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL4865309 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OOJVEAJNWMLNRT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
406.5
MW (Da)
3.18
ALogP
6
HBA
0
HBD
58.4
PSA (Ų)
0.52
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | Ki | 8.7 | 8.7 | 2.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 38.57 | mL.min-1.g-1 | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 | Ki | = | 2.0 | nM | 8.7 | Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cell membr... | 34467765 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34467765 | 10.1021/acs.jmedchem.1c00224 | 5-hydroxytryptamine receptor 3A | 2 |
| 34467765 | 10.1021/acs.jmedchem.1c00224 | 5-hydroxytryptamine receptor 6 | 2 |
| 34467765 | 10.1021/acs.jmedchem.1c00224 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine