Ligand |
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| Ligand Name: DECYLAMINE-N,N-DIMETHYL-N-OXIDE | ||
| HET ID: DDQ | PubChem: 62452 | |
| DrugBank: DB02613 | ChEMBL: CHEMBL1232157 | |
| Canonical SMILES: CCCCCCCCCC[N+](C)(C)[O-] | ||
| Standard InChI: InChI=1S/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3 | ||
| Molecular Formula: C12H27NO | Mol. Weight: 201.34888 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: False | logP: 3.7222 |
| HBD: 0 | HBA: 1 | TPSA: 29.43 |
| #Bonds: 13 | #Rotatable Bonds: 9 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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