Ligand Download |
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Ligand Name: 2,6-dichloro-N-[1-(propan-2-yl)piperidin-4-yl]benzamide | ||
HET ID: R3P | PubChem: 25236799 | |
DrugBank: - | ChEMBL: - | |
Canonical SMILES: CC(N1CCC(CC1)NC(=O)c1c(Cl)cccc1Cl)C | ||
Standard InChI: InChI=1S/C15H20Cl2N2O/c1-10(2)19-8-6-11(7-9-19)18-15(20)14-12(16)4-3-5-13(14)17/h3-5,10-11H,6-9H2,1-2H3,(H,18,20) | ||
Molecular Formula: C15H20Cl2N2O | Mol. Weight: 315.2381 | Heavy Atoms: 20 |
Charge: 0 | Is Chiral: False | logP: 3.9248 |
HBD: 1 | HBA: 3 | TPSA: 32.34 |
#Bonds: 21 | #Rotatable Bonds: 4 | Shape Complexity: 0.53333336 |
Stereocomplexity: 0.0 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Hemagglutinin | Q1KHJ8 (Q1KHJ8_9INFA) | Influenza A virus | 6VMZ |
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