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Ligand Download |
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| Ligand Name: ~{N}-[5-azanyl-2,4-bis(fluoranyl)phenyl]propane-1-sulfonamide | ||
| HET ID: SY4 | PubChem: 43550982 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: CCCS(=O)(=O)Nc1cc(N)c(cc1F)F | ||
| Standard InChI: InChI=1S/C9H12F2N2O2S/c1-2-3-16(14,15)13-9-5-8(12)6(10)4-7(9)11/h4-5,13H,2-3,12H2,1H3 | ||
| Molecular Formula: C9H12F2N2O2S | Mol. Weight: 250.26558 | Heavy Atoms: 16 |
| Charge: 0 | Is Chiral: False | logP: 3.4337 |
| HBD: 2 | HBA: 4 | TPSA: 80.57 |
| #Bonds: 16 | #Rotatable Bonds: 4 | Shape Complexity: 0.33333334 |
| Stereocomplexity: 0.0 | ||