Compound Detail
CHEMBL3093383
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Basic Information
| ChEMBL ID | CHEMBL3093383 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NXZXPZLVPNFNQN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
471.5
MW (Da)
5.40
ALogP
6
HBA
1
HBD
96.7
PSA (Ų)
0.34
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | Ki | 6.07 | 6.07 | 858.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 858.0 | nM | 6.07 | Displacement of [3H]CP-55,940 from human recombinant cannabinoid CB2 receptor ex... | 24139843 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24139843 | 10.1016/j.bmc.2013.09.040 | Cannabinoid receptor 1 | 1 |
| 24139843 | 10.1016/j.bmc.2013.09.040 | Cannabinoid receptor 2 | 1 |
| 30108881 | 10.1039/C7MD00296C | Cannabinoid receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine