Compound Detail
CHEMBL5888665
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 | CHEMBL5888665 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YWNMUBLSJLIWPI-MRXNPFEDSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
285.4
MW (Da)
2.93
ALogP
3
HBA
1
HBD
28.2
PSA (Ų)
0.91
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 8.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2C CHEMBL225 | Ki | 8.86 | 8.86 | 1.4 | 1 |
| 5-hydroxytryptamine receptor 2A CHEMBL224 | Ki | 7.36 | 7.36 | 43.4 | 1 |
| 5-hydroxytryptamine receptor 2B CHEMBL1833 | Ki | 7.23 | 7.23 | 58.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2C | Ki | = | 1.39 | nM | 8.86 | Radioligand Binding Assay: Radioligand binding assays were performed using the c... | - |
| 5-hydroxytryptamine receptor 2A | Ki | = | 43.4 | nM | 7.36 | Radioligand Binding Assay: Radioligand binding assays were performed using the c... | - |
| 5-hydroxytryptamine receptor 2B | Ki | = | 58.7 | nM | 7.23 | Radioligand Binding Assay: Radioligand binding assays were performed using the c... | - |
Data from ChEMBL 36 via Core Engine