Ligand |
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| Ligand Name: 2-aminoethyl diphenylborinate | ||
| HET ID: FZ4 | PubChem: 1598 | |
| DrugBank: - | ChEMBL: CHEMBL169233 | |
| Canonical SMILES: NCCOB(c1ccccc1)c1ccccc1 | ||
| Standard InChI: InChI=1S/C14H16BNO/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12,16H2 | ||
| Molecular Formula: C14H16BNO | Mol. Weight: 225.09393 | Heavy Atoms: 17 |
| Charge: 0 | Is Chiral: False | logP: 1.4679 |
| HBD: 1 | HBA: 2 | TPSA: 35.25 |
| #Bonds: 18 | #Rotatable Bonds: 5 | Shape Complexity: 0.14285715 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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