Compound Detail
CHEMBL34112
ACETIC ACID PENTADECYLCARBAMOYLMETHYL ESTER Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL34112 |
| Name | ACETIC ACID PENTADECYLCARBAMOYLMETHYL ESTER |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RUIAOXVTSUSVJG-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
327.5
MW (Da)
4.76
ALogP
3
HBA
1
HBD
55.4
PSA (Ų)
0.33
QED
0
Ro5 Violations
16
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 5.1 | 5.1 | 8000.0 | 1 |
| Rattus norvegicus CHEMBL376 | IC50 | 5.08 | 5.08 | 8317.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 8000.0 | nM | 5.1 | Inhibitory concentration against fatty acid amide hydrolase | 16078824 |
| Rattus norvegicus | IC50 | = | 8317.64 | nM | 5.08 | Inhibition of [3H]- AEA metabolism (N-arachidonoylethanolamine) in rat brain hom... | 12672243 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12672243 | 10.1021/jm0209679 | Rattus norvegicus | 2 |
| 12672243 | 10.1021/jm0209679 | Cannabinoid receptor 1 | 1 |
| 12672243 | 10.1021/jm0209679 | Cannabinoid receptor 2 | 1 |
| 16078824 | 10.1021/jm058183t | Fatty-acid amide hydrolase 1 | 1 |
Data from ChEMBL 36 via Core Engine