Compound Detail
CHEMBL1760551
N-SINAPOYL SEROTONIN Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1760551 |
| Name | N-SINAPOYL SEROTONIN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ADXYVJDZSILCMZ-ZZXKWVIFSA-N |
2
Targets
3
Activities
3
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
382.4
MW (Da)
2.97
ALogP
5
HBA
4
HBD
103.8
PSA (Ų)
0.47
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.51
IC50 1 meas. best 4.18
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | EC50 | 4.51 | 4.51 | 30700.0 | 1 |
| Alpha-glucosidase MAL62 CHEMBL4357 | IC50 | 4.18 | 4.18 | 66200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | EC50 | = | 30700.0 | nM | 4.51 | Antioxidant activity assessed as DPPH radical scavenging activity by spectrophot... | 21377874 |
| Alpha-glucosidase MAL62 | IC50 | = | 66200.0 | nM | 4.18 | Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranosid... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1007/s00044-011-9699-9 | Alpha-glucosidase MAL62 | 3 |
| 22386242 | 10.1016/j.bmcl.2012.02.002 | Prostaglandin G/H synthase 1 | 2 |
| 22386242 | 10.1016/j.bmcl.2012.02.002 | Prostaglandin G/H synthase 2 | 2 |
| 21377874 | 10.1016/j.bmcl.2011.02.028 | Radical scavenging activity | 1 |
| 21377874 | 10.1016/j.bmcl.2011.02.028 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine