Compound Detail
CHEMBL583068
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Basic Information
| ChEMBL ID | CHEMBL583068 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SYKKEBRXRXCNEC-AYSLTRBKSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
264.6
MW (Da)
2.18
ALogP
2
HBA
3
HBD
74.3
PSA (Ų)
0.44
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuropeptide FF receptor 2 CHEMBL5952 | EC50 | 6.3 | 6.11 | 501.2 | 2 |
| Neuropeptide FF receptor 1 CHEMBL5951 | EC50 | 5.62 | 5.62 | 2370.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuropeptide FF receptor 2 | EC50 | = | 501.19 | nM | 6.3 | Agonist activity at human NPFF2 receptor expressed in cells assessed as beta-gal... | 19803524 |
| Neuropeptide FF receptor 2 | EC50 | = | 1189.0 | nM | 5.92 | Agonist activity at human NPFF2 receptor expressed in COS1 cells assessed as [3H... | 22708927 |
| Neuropeptide FF receptor 1 | EC50 | = | 2370.0 | nM | 5.62 | Agonist activity at human NPFF1 receptor expressed in COS1 cells assessed as [3H... | 22708927 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19803524 | 10.1021/jm9011998 | Neuropeptide FF receptor 2 | 3 |
| 19803524 | 10.1021/jm9011998 | Neuropeptide FF receptor 1 | 3 |
| 19803524 | 10.1021/jm9011998 | Rattus norvegicus | 3 |
| 22708927 | 10.1021/jm300535s | Neuropeptide FF receptor 2 | 2 |
| 22708927 | 10.1021/jm300535s | Neuropeptide FF receptor 1 | 2 |
Data from ChEMBL 36 via Core Engine