Ligand |
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| Ligand Name: N-octyloctan-1-amine | ||
| HET ID: D22 | PubChem: 3094 | |
| DrugBank: - | ChEMBL: CHEMBL1232055 | |
| Canonical SMILES: CCCCCCCCNCCCCCCCC | ||
| Standard InChI: InChI=1S/C16H35N/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h17H,3-16H2,1-2H3 | ||
| Molecular Formula: C16H35N | Mol. Weight: 241.4558 | Heavy Atoms: 17 |
| Charge: 0 | Is Chiral: False | logP: 5.6879 |
| HBD: 1 | HBA: 1 | TPSA: 12.03 |
| #Bonds: 16 | #Rotatable Bonds: 14 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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