Molecule Details
| InChIKey | YAXOMMVLTBGFSG-SHCJQINQSA-N |
|---|---|
| Compound Name | 2,2''-(1,4-phenylene)bis(N-((1-(((2R,5R)-1-(2-(6-(4-fluorobenzyl)-3,3-dimethyl-5-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-b]pyridin-1-yl)-2-oxoethyl)-5-methylpiperazin-2-yl)methyl)piperidin-4-yl)methyl)-N-methylacetamide) |
| Canonical SMILES | C[C@@H]1CN(CC(=O)N2CC(C)(C)c3[nH]c(=O)c(Cc4ccc(F)cc4)cc32)[C@@H](CN2CCC(CN(C)C(=O)Cc3ccc(CC(=O)N(C)CC4CCN(C[C@H]5CN[C@H](C)CN5CC(=O)N5CC(C)(C)c6[nH]c(=O)c(Cc7ccc(F)cc7)cc65)CC4)cc3)CC2)CN1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.96 |
| Source | BindingDB |
2D Structure
Activity Profile