Compound Detail
CHEMBL357199
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 | CHEMBL357199 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JZTVSGGQBKGAKT-KRWDZBQOSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
412.5
MW (Da)
2.93
ALogP
6
HBA
1
HBD
77.1
PSA (Ų)
0.81
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.07
EC50 1 meas. best 7.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | IC50 | 7.07 | 7.07 | 85.0 | 1 |
| H9 CHEMBL614806 | EC50 | 7.07 | 7.07 | 85.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.37 | 5.37 | 4300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| H9 | EC50 | = | 85.0 | nM | 7.07 | Cytotoxicity against human H9 cells | 1919593 |
| Human immunodeficiency virus 1 | IC50 | = | 85.0 | nM | 7.07 | Antiviral activity against HIV1 HTLV-3B in human H9 cells after 3 days by p24 an... | 1919593 |
| Unchecked | IC50 | = | 4300.0 | nM | 5.37 | Concentration was evaluated for its ability to inhibit microtubule assembly and ... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)81108-2 | Unchecked | 1 |
| 1919593 | 10.1021/np50074a052 | Human immunodeficiency virus 1 | 1 |
| 1919593 | 10.1021/np50074a052 | H9 | 1 |
Data from ChEMBL 36 via Core Engine