Compound Detail
CHEMBL3585363
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 | CHEMBL3585363 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NETCGGLKJGMCRY-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3586727 |
| Active Moiety | CHEMBL3586727 |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
218.3
MW (Da)
1.72
ALogP
2
HBA
2
HBD
41.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | EC50 | 7.07 | 7.07 | 85.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | EC50 | = | 85.11 | nM | 7.07 | Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes ... | - |
| D(2) dopamine receptor | EC50 | = | 85.0 | nM | 7.07 | Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00066H | D(2) dopamine receptor | 3 |
Data from ChEMBL 36 via Core Engine