Compound Detail
CHEMBL94568
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Basic Information
| ChEMBL ID | CHEMBL94568 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CBLWTSAIPKCIAJ-IUFJOMBNSA-N |
| Parent Compound | CHEMBL1179698 |
| Active Moiety | CHEMBL1179698 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
339.5
MW (Da)
3.67
ALogP
3
HBA
1
HBD
32.7
PSA (Ų)
0.84
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | Kd | 6.19 | 6.19 | 645.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | Kd | = | 645.65 | nM | 6.19 | Antimuscarinic potency is measured as its ability to block ACh-induced contracti... | 3806613 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3806613 | 10.1021/jm00385a009 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine