Molecule Details
| InChIKey | NNNQXCYHIVPZRH-UHFFFAOYSA-N |
|---|---|
| Compound Name | 5-Hexyl-2-(4-nitrophenoxy)phenol |
| Canonical SMILES | CCCCCCc1ccc(Oc2ccc([N+](=O)[O-])cc2)c(O)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.9 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P9WGR1 | inhA | Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) | Pathogen | PF13561 | 7.0 | IC50 | ChEMBL;BindingDB |
| Q8Z9U1 | fabV | Yersinia pestis | Pathogen | PF07055 PF12242 PF12241 | 6.8 | IC50 | BindingDB |
| Q3JG55 | fabI-1 | Burkholderia pseudomallei (strain 1710b) | Pathogen | PF13561 | 6.8 | Ki | BindingDB |