Compound Detail
CHEMBL3697573
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 | CHEMBL3697573 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YEIFIKANSHBAMX-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
339.4
MW (Da)
2.25
ALogP
6
HBA
2
HBD
97.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 7.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(1A) dopamine receptor CHEMBL2056 | Ki | 7.08 | 7.08 | 82.7 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(1A) dopamine receptor | Ki | = | 82.7 | nM | 7.08 | Competition Binding Assay: The affinity of the compounds described herein was de... | - |
| D(1A) dopamine receptor | Ki | = | 82.7 | nM | 7.08 | Human D1 Receptor Binding Assay: The affinity of the compounds described herein ... | - |
| D(1A) dopamine receptor | Ki | = | 82.7 | nM | 7.08 | Receptor Binding Assay: D1 binding assays were performed using over-expressing L... | - |
Data from ChEMBL 36 via Core Engine