Ligand |
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| Ligand Name: N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide | ||
| HET ID: SP5 | PubChem: 916 | |
| DrugBank: - | ChEMBL: CHEMBL131004 | |
| Canonical SMILES: NCCCNCCCCNCCCNC(=O)C | ||
| Standard InChI: InChI=1S/C12H28N4O/c1-12(17)16-11-5-10-15-8-3-2-7-14-9-4-6-13/h14-15H,2-11,13H2,1H3,(H,16,17) | ||
| Molecular Formula: C12H28N4O | Mol. Weight: 244.37692 | Heavy Atoms: 17 |
| Charge: 0 | Is Chiral: False | logP: 1.6938 |
| HBD: 4 | HBA: 5 | TPSA: 79.18 |
| #Bonds: 16 | #Rotatable Bonds: 13 | Shape Complexity: 0.9166667 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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