Compound Detail
CHEMBL4856628
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 | CHEMBL4856628 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NZTNTJJXYHMEGN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
307.4
MW (Da)
4.23
ALogP
3
HBA
2
HBD
36.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | Ki | 6.07 | 6.07 | 848.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 848.0 | nM | 6.07 | Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhi... | 33691168 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33691168 | 10.1016/j.bmcl.2021.127911 | Muscarinic acetylcholine receptor M1 | 2 |
| 33691168 | 10.1016/j.bmcl.2021.127911 | Muscarinic acetylcholine receptor M2 | 1 |
| 33691168 | 10.1016/j.bmcl.2021.127911 | Muscarinic acetylcholine receptor M3 | 1 |
| 33691168 | 10.1016/j.bmcl.2021.127911 | Muscarinic acetylcholine receptor M4 | 1 |
| 33691168 | 10.1016/j.bmcl.2021.127911 | D(2) dopamine receptor | 1 |
| 33691168 | 10.1016/j.bmcl.2021.127911 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine