Compound Detail
CHEMBL3251784
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Basic Information
| ChEMBL ID | CHEMBL3251784 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MDCBURXXBZEVGT-AAEUAGOBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
207.3
MW (Da)
2.41
ALogP
2
HBA
2
HBD
32.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 5.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Felis catus CHEMBL612670 | Kd | 5.47 | 5.47 | 3388.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Felis catus | Kd | = | 3388.44 | nM | 5.47 | In vivo inhibition of beta-2 adrenoceptor in chloralose-anesthetized vagotomized... | 27636 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27636 | 10.1021/jm00205a016 | Felis catus | 3 |
| 27636 | 10.1021/jm00205a016 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine