Compound Detail
CHEMBL60381
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Basic Information
| ChEMBL ID | CHEMBL60381 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DCPCHBMAICQGGJ-PHDIDXHHSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
248.6
MW (Da)
-0.95
ALogP
6
HBA
2
HBD
93.5
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| ADMET CHEMBL612558 | EC50 | 5.17 | 5.17 | 6800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| ADMET | EC50 | = | 6800.0 | nM | 5.17 | Effective concentration against HIV-1 in peripheral blood mononuclear cells (PBM... | 1597854 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1597854 | 10.1021/jm00089a007 | ADMET | 2 |
| 1597854 | 10.1021/jm00089a007 | Vero | 1 |
Data from ChEMBL 36 via Core Engine