Compound Detail
CHEMBL1312767
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Basic Information
| ChEMBL ID | CHEMBL1312767 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ULVXDYPPPUOAAO-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
328.4
MW (Da)
3.63
ALogP
5
HBA
1
HBD
90.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.01
IC50 1 meas. best 5.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HEK293 CHEMBL614818 | IC50 | 5.09 | 5.09 | 8169.0 | 1 |
| Neuropeptide Y receptor type 1 CHEMBL4777 | EC50 | 5.01 | 5.01 | 9709.0 | 1 |
| Neuropeptide Y receptor type 2 CHEMBL4018 | EC50 | 4.92 | 4.92 | 12090.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HEK293 | IC50 | = | 8169.0 | nM | 5.09 | PUBCHEM_BIOASSAY: Fluorescence-based counterscreen for potentiators or agonists ... | - |
| Neuropeptide Y receptor type 1 | EC50 | = | 9709.0 | nM | 5.01 | PUBCHEM_BIOASSAY: Fluorescence-based dose response cell-based high-throughput sc... | - |
| Neuropeptide Y receptor type 2 | EC50 | = | 12090.0 | nM | 4.92 | PUBCHEM_BIOASSAY: Fluorescence-based counterscreen for agonists of NPY-Y1: cell-... | - |
Data from ChEMBL 36 via Core Engine