 |
| Ligand Name:
N-[2-(diethylamino)ethyl]-1-(4-methylphenyl)methanesulfonamide |
| HET ID: Q4Q |
PubChem:
71677771
|
| DrugBank: - |
ChEMBL: CHEMBL3087806 |
| Canonical SMILES: CCN(CCNS(=O)(=O)Cc1ccc(cc1)C)CC |
| Standard InChI: InChI=1S/C14H24N2O2S/c1-4-16(5-2)11-10-15-19(17,18)12-14-8-6-13(3)7-9-14/h6-9,15H,4-5,10-12H2,1-3H3 |
| Molecular Formula: C14H24N2O2S |
Mol. Weight: 284.41757 |
Heavy Atoms: 19 |
| Charge: 0 |
Is Chiral: False |
logP: 3.2279 |
| HBD: 1 |
HBA: 4 |
TPSA: 57.79 |
| #Bonds: 19 |
#Rotatable Bonds: 8 |
Shape Complexity: 0.5714286 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |