Compound Detail
CHEMBL1084940
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Basic Information
| ChEMBL ID | CHEMBL1084940 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JIIPPGCWHGFEFP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
371.3
MW (Da)
3.23
ALogP
4
HBA
0
HBD
55.2
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | EC50 | 5.92 | 5.92 | 1200.0 | 1 |
| Muscarinic acetylcholine receptor M1 CHEMBL276 | EC50 | 5.91 | 5.91 | 1230.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | EC50 | = | 1200.0 | nM | 5.92 | Potentiation of muscarinic M1 receptor expressed in CHO cells assessed as effect... | 20156687 |
| Muscarinic acetylcholine receptor M1 | EC50 | = | 1230.0 | nM | 5.91 | PUBCHEM_BIOASSAY: Discovery of novel allosteric modulators of the M1 muscarinic ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20156687 | 10.1016/j.bmcl.2010.01.109 | Muscarinic acetylcholine receptor M1 | 2 |
Data from ChEMBL 36 via Core Engine