Ligand |
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| Ligand Name: ~{N}-(3,3-diphenylpropyl)piperidin-4-amine | ||
| HET ID: 5UW | PubChem: 133107882 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: N1CCC(CC1)NCCC(c1ccccc1)c1ccccc1 | ||
| Standard InChI: InChI=1S/C20H26N2/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)13-16-22-19-11-14-21-15-12-19/h1-10,19-22H,11-16H2 | ||
| Molecular Formula: C20H26N2 | Mol. Weight: 294.43384 | Heavy Atoms: 22 |
| Charge: 0 | Is Chiral: False | logP: 4.2699 |
| HBD: 2 | HBA: 2 | TPSA: 24.06 |
| #Bonds: 24 | #Rotatable Bonds: 6 | Shape Complexity: 0.4 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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