Compound Detail
CHEMBL1224894
SALCOLIN B Enter ChEMBL ID:
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COc1cc([C@H](O)[C@H](CO)Oc2c(OC)cc(-c3cc(=O)c4c(O)cc(O)cc4o3)cc2OC)ccc1O
Basic Information
| ChEMBL ID | CHEMBL1224894 |
| Name | SALCOLIN B |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WXNJNHFYIWEHIL-AHWVRZQESA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
526.5
MW (Da)
3.08
ALogP
11
HBA
5
HBD
168.3
PSA (Ų)
0.22
QED
2
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.88 | 4.88 | 13300.0 | 1 |
| RAW264.7 CHEMBL612557 | IC50 | 4.53 | 4.53 | 29500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 13300.0 | nM | 4.88 | Antioxidant activity assessed as hydroxyl radical scavenging activity by chemilu... | 20825224 |
| RAW264.7 | IC50 | = | 29500.0 | nM | 4.53 | Antiinflammatory activity against LPS-stimulated mouse RAW264.7 cells assessed a... | 20825224 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20825224 | 10.1021/np100181c | RAW264.7 | 3 |
| 20825224 | 10.1021/np100181c | NON-PROTEIN TARGET | 2 |
| 20825224 | 10.1021/np100181c | Radical scavenging activity | 1 |
| 21469695 | 10.1021/np200117y | PC-12 | 1 |
| 21469695 | 10.1021/np200117y | Peritoneal macrophage cell | 1 |
| 21469695 | 10.1021/np200117y | Human immunodeficiency virus 1 | 1 |
| 21469695 | 10.1021/np200117y | Liver microsomes | 1 |
| 21469695 | 10.1021/np200117y | Unchecked | 1 |
| 21469695 | 10.1021/np200117y | A549 | 1 |
| 21469695 | 10.1021/np200117y | BGC-823 | 1 |
| 21469695 | 10.1021/np200117y | MCF7 | 1 |
| 21469695 | 10.1021/np200117y | Bel-7402 | 1 |
| 21469695 | 10.1021/np200117y | KETR3 | 1 |
| 21469695 | 10.1021/np200117y | HCT-8 | 1 |
Data from ChEMBL 36 via Core Engine