Compound Detail
CHEMBL3885394
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
C[n+]1ccc(Sc2c(F)c(F)c(-c3c4nc(c(-c5c(F)c(F)c(Sc6cc[n+](C)cc6)c(F)c5F)c5ccc([nH]5)c(-c5c(F)c(F)c(Sc6cc[n+](C)cc6)c(F)c5F)c5nc(c(-c6c(F)c(F)c(Sc7cc[n+](C)cc7)c(F)c6F)c6ccc3[nH]6)C=C5)C=C4)c(F)c2F)cc1.[I-].[I-].[I-].[I-]
Basic Information
| ChEMBL ID | CHEMBL3885394 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QIDTVZNUDCTKTR-LHGVWXAPSA-J |
| Parent Compound | CHEMBL3990402 |
| Active Moiety | CHEMBL3990402 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1399.3
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.62 | 6.62 | 240.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 240.3 | nM | 6.62 | Phototoxicity against human HaCaT cells assessed as reduction in cell viability ... | 27956348 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27956348 | 10.1016/j.bmcl.2016.11.094 | No relevant target | 3 |
| 27956348 | 10.1016/j.bmcl.2016.11.094 | NON-PROTEIN TARGET | 2 |
Data from ChEMBL 36 via Core Engine