Compound Detail
CHEMBL308744
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 | CHEMBL308744 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FJMWICTXKAHSOH-WLHGVMLRSA-N |
| Parent Compound | CHEMBL1183636 |
| Active Moiety | CHEMBL1183636 |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
281.4
MW (Da)
3.07
ALogP
5
HBA
0
HBD
38.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL276 | IC50 | 8.08 | 8.04 | 8.4 | 2 |
| Oryctolagus cuniculus CHEMBL374 | IC50 | 7.33 | 7.33 | 47.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | IC50 | = | 8.4 | nM | 8.08 | In vitro binding affinity against muscarinic acetylcholine receptor M1 from rat ... | 1613751 |
| Muscarinic acetylcholine receptor M1 | IC50 | = | 10.0 | nM | 8.0 | In vitro binding affinity against muscarinic acetylcholine receptor M1 from rat ... | 1613751 |
| Oryctolagus cuniculus | IC50 | = | 47.0 | nM | 7.33 | In vitro inhibition of twitch height in electrically stimulated rabbit vas defer... | 1613751 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1613751 | 10.1021/jm00090a019 | Muscarinic acetylcholine receptor M1 | 2 |
| 1613751 | 10.1021/jm00090a019 | Oryctolagus cuniculus | 2 |
| 1613751 | 10.1021/jm00090a019 | Cavia porcellus | 2 |
Data from ChEMBL 36 via Core Engine