Compound Detail
CHEMBL5966740
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Cc1ccc(S(=O)(=O)n2c(C)c(-c3nc(NC(C)(C)C)c4ccncc4n3)c3cccnc32)cc1
Basic Information
| ChEMBL ID | CHEMBL5966740 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KXSUMCWTBFNYKH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
486.6
MW (Da)
5.11
ALogP
8
HBA
1
HBD
102.7
PSA (Ų)
0.38
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase LATS1 CHEMBL6167 | IC50 | 8.7 | 8.7 | 2.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase LATS1 | IC50 | = | 2.0 | nM | 8.7 | LATS1 Biochemical Assay: Homogenous Time Resolved Fluorescence (HTRF) Assay: The... | - |
Data from ChEMBL 36 via Core Engine