Compound Detail
CHEMBL6030983
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Basic Information
| ChEMBL ID | CHEMBL6030983 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VGZWOWCODLGQKC-PKNBQFBNSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
350.4
MW (Da)
2.86
ALogP
5
HBA
3
HBD
79.2
PSA (Ų)
0.35
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase 1 CHEMBL325 | IC50 | 6.64 | 6.64 | 230.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase 1 | IC50 | = | 230.0 | nM | 6.64 | In Vitro HDAC Assay: The assay has been carried out in 96 well format and the BI... | - |
| Histone deacetylase 1 | IC50 | = | 230.0 | nM | 6.64 | Enzyme Assay: The assay has been carried out in 96 well format and the BIOMOL fl... | - |
Data from ChEMBL 36 via Core Engine