Ligand |
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| Ligand Name: 2-bromobenzoic acid | ||
| HET ID: 7WV | PubChem: 6940 | |
| DrugBank: - | ChEMBL: CHEMBL115950 | |
| Canonical SMILES: OC(=O)c1ccccc1Br | ||
| Standard InChI: InChI=1S/C7H5BrO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10) | ||
| Molecular Formula: C7H5BrO2 | Mol. Weight: 201.0174 | Heavy Atoms: 10 |
| Charge: 0 | Is Chiral: False | logP: 2.1473 |
| HBD: 1 | HBA: 2 | TPSA: 37.3 |
| #Bonds: 10 | #Rotatable Bonds: 1 | Shape Complexity: 0.0 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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