Compound Detail
CHEMBL405832
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CC(CCC(=O)O)C1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@@H](OCCNC(=O)CCC(=O)NCCCNC(=O)CCC(C)C5CC[C@H]6[C@@H]7[C@H](O)C[C@@H]8C[C@H](OC(c9ccccc9)c9ccccc9)CC[C@]8(C)[C@H]7C[C@H](O)[C@]56C)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
Basic Information
| ChEMBL ID | CHEMBL405832 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GVABOOGBOVQMEP-SBDHIBRRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1164.6
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Oryctolagus cuniculus CHEMBL374 | IC50 | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Oryctolagus cuniculus | IC50 | = | 19000.0 | nM | 4.72 | The compound was evaluated for the inhibition of Na+-dependent [3H]taurocholate ... | 8151614 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8151614 | 10.1021/jm00033a001 | Oryctolagus cuniculus | 3 |
| 8151614 | 10.1021/jm00033a001 | Rattus norvegicus | 3 |
Data from ChEMBL 36 via Core Engine