Compound Detail
CHEMBL32827
HEXADECANOIC ACID ISOPROPYLAMIDE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL32827 |
| Name | HEXADECANOIC ACID ISOPROPYLAMIDE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZYVUGCYYQOTQR-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
297.5
MW (Da)
5.99
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.37
QED
1
Ro5 Violations
15
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 7.89 | 7.89 | 13.0 | 1 |
| Rattus norvegicus CHEMBL376 | IC50 | 4.89 | 4.87 | 12882.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 13.0 | nM | 7.89 | Inhibitory concentration against fatty acid amide hydrolase | 16078824 |
| Rattus norvegicus | IC50 | = | 12882.5 | nM | 4.89 | Inhibition of [3H]- AEA metabolism (N-arachidonoylethanolamine) in rat brain hom... | 12672243 |
| Rattus norvegicus | IC50 | = | 14125.38 | nM | 4.85 | Inhibition of [3H]- AEA metabolism (N-arachidonoylethanolamine) using rat brain ... | 12672243 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12672243 | 10.1021/jm0209679 | Rattus norvegicus | 5 |
| 14521402 | 10.1021/jm0340795 | Fatty-acid amide hydrolase 1 | 2 |
| 21257314 | 10.1016/j.bmc.2010.12.046 | HaCaT | 2 |
| 12672243 | 10.1021/jm0209679 | Cannabinoid receptor 1 | 1 |
| 12672243 | 10.1021/jm0209679 | Cannabinoid receptor 2 | 1 |
| 14521402 | 10.1021/jm0340795 | Cannabinoid receptor 1 | 1 |
| 14521402 | 10.1021/jm0340795 | Cannabinoid receptor 2 | 1 |
| 14521402 | 10.1021/jm0340795 | N-acylethanolamine-hydrolyzing acid amidase | 1 |
| 16078824 | 10.1021/jm058183t | Fatty-acid amide hydrolase 1 | 1 |
Data from ChEMBL 36 via Core Engine