Compound Detail
CHEMBL1424680
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Basic Information
| ChEMBL ID | CHEMBL1424680 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QCXXDKAQXWJZHU-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1620480 |
| Active Moiety | CHEMBL1620480 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
361.5
MW (Da)
3.71
ALogP
6
HBA
1
HBD
55.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Heat shock protein HSP90 CHEMBL2095165 | IC50 | 4.89 | 4.89 | 13003.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Heat shock protein HSP90 | IC50 | = | 13003.8 | nM | 4.89 | PUBCHEM_BIOASSAY: Tumor Hsp90 Inhibitors Dose Response Confirmation. (Class of a... | - |
Data from ChEMBL 36 via Core Engine