Compound Detail
CHEMBL5859828
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)c2ccccn2)C(C)(C)C)cc1
Basic Information
| ChEMBL ID | CHEMBL5859828 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GENALQNUPMUAKG-JCTONOIOSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
535.7
MW (Da)
2.94
ALogP
7
HBA
3
HBD
124.5
PSA (Ų)
0.43
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor CHEMBL3108660 | IC50 | 6.09 | 6.04 | 810.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 6.09 | 6.04 | 810.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| von Hippel-Lindau disease tumor suppressor | IC50 | = | 810.0 | nM | 6.09 | Fluorescence Polarization Assay (10% DMSO): Ability of VHL ligands to compete fo... | - |
| Unchecked | IC50 | = | 810.0 | nM | 6.09 | Fluorescence Polarization Assay (10% in DMSO): Ability of VHL ligands to compete... | - |
| von Hippel-Lindau disease tumor suppressor | IC50 | = | 1030.0 | nM | 5.99 | Fluorescence Polarization Assay (1% DMSO): Ability of VHL ligands to compete for... | - |
| Unchecked | IC50 | = | 1030.0 | nM | 5.99 | Fluorescence Polarization Assay (1% in DMSO): Ability of VHL ligands to compete ... | - |
Data from ChEMBL 36 via Core Engine