Compound Detail
CHEMBL5839808
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Basic Information
| ChEMBL ID | CHEMBL5839808 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SPDQCCQZMWCVQE-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
289.4
MW (Da)
3.55
ALogP
3
HBA
0
HBD
46.6
PSA (Ų)
0.69
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-acylethanolamine-hydrolyzing acid amidase CHEMBL4349 | IC50 | 4.68 | 4.68 | 21000.0 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 4.48 | 4.48 | 33000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-acylethanolamine-hydrolyzing acid amidase | IC50 | = | 21000.0 | nM | 4.68 | Determining Endocannabinoid Hydrolase Activity: In the Experimental example, end... | - |
| Fatty-acid amide hydrolase 1 | IC50 | = | 33000.0 | nM | 4.48 | Determining Endocannabinoid Hydrolase Activity: In the Experimental example, end... | - |
Data from ChEMBL 36 via Core Engine