Compound Detail
CHEMBL5820786
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CCc1cnccc1S(=O)(=O)c1ccc(N2CC(CN3CCC(C4(C5CCCC5)CN(CC)Cc5ccccc54)CC3)C2)cc1
Basic Information
| ChEMBL ID | CHEMBL5820786 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RDYSNHBFNDOPNP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
626.9
MW (Da)
6.59
ALogP
6
HBA
0
HBD
56.8
PSA (Ų)
0.27
QED
2
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Menin CHEMBL1615381 | IC50 | 8.1 | 8.1 | 8.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Menin | IC50 | = | 8.0 | nM | 8.1 | Fluorescence Polarization (FP) Competitive Binding Assay: A fluorescence polariz... | - |
Data from ChEMBL 36 via Core Engine