Compound Detail
CHEMBL4208614
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CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCOCCOCCOCCNC(=O)CCCCCC(=O)NCCc1ccc(O)c([C@H](CCN(C(C)C)C(C)C)c2ccccc2)c1)OC(=O)CCCCCCCCCCCCCCCCC
Basic Information
| ChEMBL ID | CHEMBL4208614 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KMUDKLONISBNBI-MPWJUPNPSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
1358.9
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | IC50 | 7.74 | 7.74 | 18.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | IC50 | = | 18.2 | nM | 7.74 | Displacement of [3H]NMS from muscarinic receptor in Sprague-Dawley rat brain hom... | 29652494 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29652494 | 10.1021/acs.jmedchem.8b00041 | Muscarinic acetylcholine receptor | 3 |
Data from ChEMBL 36 via Core Engine