Compound Detail
CHEMBL220486
VARIOLARIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL220486 |
| Name | VARIOLARIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LPUOVEFMUOQBFV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
314.2
MW (Da)
2.40
ALogP
7
HBA
2
HBD
102.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| B16 CHEMBL381 | IC50 | 4.41 | 4.41 | 38700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| B16 | IC50 | = | 38700.0 | nM | 4.41 | Cytotoxicity against murine B16 cells by MTT assay | 17256903 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27300079 | 10.1021/acs.jnatprod.5b00962 | NON-PROTEIN TARGET | 5 |
| 27300079 | 10.1021/acs.jnatprod.5b00962 | Kinesin-like protein KIF20B | 4 |
| 17256903 | 10.1021/np060561p | B16 | 1 |
Data from ChEMBL 36 via Core Engine