Compound Detail
CHEMBL1794941
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Basic Information
| ChEMBL ID | CHEMBL1794941 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IYEQMJOHAPFPSZ-FJOGWHKWSA-N |
| Parent Compound | CHEMBL284802 |
| Active Moiety | CHEMBL284802 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
259.4
MW (Da)
2.09
ALogP
4
HBA
0
HBD
12.5
PSA (Ų)
0.66
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.89 | 6.89 | 130.0 | 1 |
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 5.83 | 5.83 | 1470.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 130.0 | nM | 6.89 | Binding affinity against muscarinic acetylcholine receptor from rat brain crude ... | 7739014 |
| Muscarinic acetylcholine receptor | Ki | = | 1470.0 | nM | 5.83 | Binding affinity against muscarinic acetylcholine receptor from rat brain crude ... | 7739014 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7739014 | 10.1021/jm00009a016 | Muscarinic acetylcholine receptor | 2 |
| 7739014 | 10.1021/jm00009a016 | Rattus norvegicus | 1 |
| 7739014 | 10.1021/jm00009a016 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine