Compound Detail
CHEMBL486619
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C=C[C@@]1(C)CC(=O)[C@]2(O)[C@@]3(C)[C@@H](O)CCC(C)(C)[C@@H]3[C@H](O)[C@H](O)[C@@]2(C)O1
Basic Information
| ChEMBL ID | CHEMBL486619 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WPDITXOBNLYZHH-KAACEJSMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
368.5
MW (Da)
0.95
ALogP
6
HBA
4
HBD
107.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | EC50 | 5.15 | 5.15 | 7100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | EC50 | = | 7100.0 | nM | 5.15 | Compound was tested for inhibition of glucose transport in adipocytes plasma mem... | 10406641 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6682146 | 10.1021/jm00358a006 | Felis catus | 2 |
| 10406641 | 10.1016/s0960-894x(99)00270-x | Rattus norvegicus | 1 |
| 6682146 | 10.1021/jm00358a006 | Rattus norvegicus | 1 |
| 6682146 | 10.1021/jm00358a006 | Cavia porcellus | 1 |
| 2849641 | 10.1021/np50059a019 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine