Compound Detail
CHEMBL5755036
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
COc1ncnc(C2CC2)c1-c1ncc2cnn(Cc3ccc(-c4nc(C(F)(F)F)n(C)n4)cc3)c2n1
Basic Information
| ChEMBL ID | CHEMBL5755036 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WWNIXXWCMPELNP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
507.5
MW (Da)
4.03
ALogP
10
HBA
0
HBD
109.3
PSA (Ų)
0.34
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ubiquitin carboxyl-terminal hydrolase 1 CHEMBL1795087 | IC50 | 7.26 | 7.26 | 55.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ubiquitin carboxyl-terminal hydrolase 1 | IC50 | = | 55.0 | nM | 7.26 | Inhibitor Assay: Deubiquitinase activity was measured using ubiquitin-rhodamine ... | - |
Data from ChEMBL 36 via Core Engine