Compound Detail
CHEMBL3621991
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3621991 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RNGDZSGDGWSNCC-LFYBBSHMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
265.4
MW (Da)
4.29
ALogP
2
HBA
1
HBD
43.1
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HL-60 CHEMBL383 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HL-60 | IC50 | = | 10000.0 | nM | 5.0 | Cytotoxicity against human HL60 cells after 72 hrs by MTT assay | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00371C | HCT-116 | 1 |
| - | 10.1039/C4MD00371C | HL-60 | 1 |
| - | 10.1039/C4MD00371C | OVCAR-8 | 1 |
| - | 10.1039/C4MD00371C | SF-295 | 1 |
| - | 10.1039/C4MD00371C | PBMC | 1 |
Data from ChEMBL 36 via Core Engine