|
Ligand Download |
||
 | ||
| Ligand Name: 4-(methylsulfonylamino)benzamide | ||
| HET ID: S2S | PubChem: 961874 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: NC(=O)c1ccc(cc1)NS(=O)(=O)C | ||
| Standard InChI: InChI=1S/C8H10N2O3S/c1-14(12,13)10-7-4-2-6(3-5-7)8(9)11/h2-5,10H,1H3,(H2,9,11) | ||
| Molecular Formula: C8H10N2O3S | Mol. Weight: 214.2416 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: False | logP: 2.0111 |
| HBD: 2 | HBA: 5 | TPSA: 97.64 |
| #Bonds: 14 | #Rotatable Bonds: 3 | Shape Complexity: 0.125 |
| Stereocomplexity: 0.0 | ||