Compound Detail
CHEMBL1493864
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CCN(CC)S(=O)(=O)c1cc(NC(=O)CNc2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1C
Basic Information
| ChEMBL ID | CHEMBL1493864 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KDQFNBFRSFIJGL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
524.7
MW (Da)
2.10
ALogP
7
HBA
2
HBD
125.1
PSA (Ų)
0.49
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Galanin receptor type 3 CHEMBL2731 | IC50 | 6.35 | 6.35 | 449.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Galanin receptor type 3 | IC50 | = | 449.14 | nM | 6.35 | PubChem BioAssay. Fluorescence-based cell-based primary high throughput dose res... | - |
Data from ChEMBL 36 via Core Engine