Ligand |
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| Ligand Name: Alpha-Bromo-3-Iodotoluene | ||
| HET ID: 8Z5 | PubChem: 2759361 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: BrCc1cccc(c1)I | ||
| Standard InChI: InChI=1S/C7H6BrI/c8-5-6-2-1-3-7(9)4-6/h1-4H,5H2 | ||
| Molecular Formula: C7H6BrI | Mol. Weight: 296.931 | Heavy Atoms: 9 |
| Charge: 0 | Is Chiral: False | logP: 3.1861 |
| HBD: 0 | HBA: 0 | TPSA: 0.0 |
| #Bonds: 9 | #Rotatable Bonds: 1 | Shape Complexity: 0.14285715 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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