Compound Detail
CHEMBL5768466
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CS(=O)(=O)CC(=O)Nc1c2c(nn1-c1ccc(C(F)F)nn1)C[C@]1(CCc3cc(OCCCC(F)(F)F)ccc31)NC2=O
Basic Information
| ChEMBL ID | CHEMBL5768466 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RPVMDMILOXEIFY-VWLOTQADSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
628.6
MW (Da)
3.43
ALogP
9
HBA
2
HBD
145.2
PSA (Ų)
0.27
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase CHEMBL2321630 | IC50 | 9.54 | 9.54 | 0.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase | IC50 | = | 0.285 | nM | 9.54 | Inhibitory Activity: Solutions of the compounds of the present invention in DMSO... | - |
Data from ChEMBL 36 via Core Engine