Compound Detail
CHEMBL1445768
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Basic Information
| ChEMBL ID | CHEMBL1445768 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LYWBUZFSUSAVGV-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1621743 |
| Active Moiety | CHEMBL1621743 |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
3.52
ALogP
4
HBA
0
HBD
39.2
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.46 | 5.41 | 3460.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 3460.0 | nM | 5.46 | PUBCHEM_BIOASSAY: Fluorescent HTS Cytotoxicity/Cell viability assay (HPDE-C7 cel... | - |
| Unchecked | EC50 | = | 4380.0 | nM | 5.36 | PUBCHEM_BIOASSAY: Fluorescent HTS Cytotoxicity/Cell viability assay (HPDE-C7K ce... | - |
Data from ChEMBL 36 via Core Engine