Compound Detail
CHEMBL1699195
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Basic Information
| ChEMBL ID | CHEMBL1699195 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OLRNHUWTPFMAFD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
479.0
MW (Da)
2.55
ALogP
7
HBA
1
HBD
74.9
PSA (Ų)
0.46
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL233 | IC50 | 5.4 | 5.4 | 3980.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | IC50 | = | 3980.0 | nM | 5.4 | PUBCHEM_BIOASSAY: SAR Analysis of Antagonists of the MOR Receptor using an Image... | - |
Data from ChEMBL 36 via Core Engine