Ligand |
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| Ligand Name: 6-dipropylamino-1-hexanol | ||
| HET ID: 96K | PubChem: 142645 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: CCCN(CCC)CCCCCCO | ||
| Standard InChI: InChI=1S/C12H27NO/c1-3-9-13(10-4-2)11-7-5-6-8-12-14/h14H,3-12H2,1-2H3 | ||
| Molecular Formula: C12H27NO | Mol. Weight: 201.34888 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: False | logP: 2.6611 |
| HBD: 1 | HBA: 2 | TPSA: 23.47 |
| #Bonds: 13 | #Rotatable Bonds: 10 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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