Molecule Details
| InChIKey | AFKHWKJSOKSDOT-ONKNJJKASA-N |
|---|---|
| Canonical SMILES | [C]S[C][C][C@H]([N]C(=O)[C@H]([C][C]C([N])=O)[N]C(=O)[C@H]([C][C][C][C][N])[N]C(=O)[C@H]([C][C][C]N=C([N])[N])[N]C(=O)[C@H]([C]c1ccc([O])cc1)[N]C(=O)[C@H]([C][C][C]N=C([N])[N])[N]C(=O)[C@H]([C][O])[N]C(=O)[C@H]([C]c1ccc([O])cc1)[N]C(=O)[C@H]([C][O])[N]C(=O)[C@H]([C]C([O])=O)[N]C(=O)[C@@H]([N]C(=O)[C@@H]([N])[C]c1ccccc1)[C@@H]([C])[O])C(=O)[N][C@@H]([C])C(=O)[N][C@@H]([C]([C])[C])C(=O)[N][C@@H]([C][C][C][C][N])C(=O)[N][C@@H]([C][C][C][C][N])C(=O)[N][C@@H]([C]c1ccc([O])cc1)C(=O)[N][C@@H]([C][C]([C])[C])C(=O)[N][C@@H]([C])C(=O)[N][C@@H]([C])C(=O)[N][C@@H]([C]([C])[C])C(=O)[N][C@@H]([C][C]([C])[C])C(=O)[N][C]C(=O)[N][C@@H]([C][C][C][C][N])C(=O)[N][C@@H]([C][C][C]N=C([N])[N])C(=O)[N][C@@H]([C]c1ccc([O])cc1)C(=O)[N][C@@H]([C][C][C][C][N])C(=O)[N][C@@H]([C][C]C([N])=O)C(=O)[N][C@@H]([C][C][C]N=C([N])[N])C(=O)[N][C@@H]([C]([C])[C])C(=O)[N][C@@H]([C][C][C][C][N])C(=O)[N][C@@H]([C]C([N])=O)C(=O)[N][C@@H]([C][C][C][C][N])C([N])=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.04 |
| Source | BindingDB |
2D Structure
Activity Profile