Ligand Download |
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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 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Acetylpolyamine amidohydrolase | Q48935 (APAH_MYCRA) | Mycoplana ramosa | 3Q9E |
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