Compound Detail
CHEMBL556809
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Basic Information
| ChEMBL ID | CHEMBL556809 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PLQHIVZDQXNMRG-BFUOFWGJSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
2
Publications
0
Known Names
Molecular Properties
273.3
MW (Da)
3.54
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 171.0 | hr | - |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 1100.0 | nM | 5.96 | Cytotoxicity against mouse L1210 cells | 19639994 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19639994 | 10.1021/jm9006214 | L1210 | 1 |
| 19639994 | 10.1021/jm9006214 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine