Compound Detail
CHEMBL448736
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Basic Information
| ChEMBL ID | CHEMBL448736 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDLFRSLLLNNFMI-LYNSQETBSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
195.3
MW (Da)
0.83
ALogP
3
HBA
0
HBD
29.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 7.52 | 7.52 | 30.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 7.52 | 7.52 | 30.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 30.0 | nM | 7.52 | Binding affinity against muscarinic acetylcholine receptor from rat brain crude ... | 7739014 |
| Muscarinic acetylcholine receptor | Ki | = | 30.0 | nM | 7.52 | Binding affinity against Muscarinic acetylcholine receptor using [3H]-OXO-M as t... | 9784090 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7739014 | 10.1021/jm00009a016 | Muscarinic acetylcholine receptor | 1 |
| 7739014 | 10.1021/jm00009a016 | Unchecked | 1 |
| 9784090 | 10.1021/jm980192x | Muscarinic acetylcholine receptor | 1 |
| 9784090 | 10.1021/jm980192x | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine