Ligand |
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| Ligand Name: 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID | ||
| HET ID: CXS | PubChem: 12546061, 70815 | |
| DrugBank: DB02219 | ChEMBL: CHEMBL1231999 | |
| Canonical SMILES: OS(=O)(=O)CCCNC1CCCCC1 | ||
| Standard InChI: InChI=1S/C9H19NO3S/c11-14(12,13)8-4-7-10-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,11,12,13) | ||
| Molecular Formula: C9H19NO3S | Mol. Weight: 221.31706 | Heavy Atoms: 14 |
| Charge: 0 | Is Chiral: False | logP: 2.6583 |
| HBD: 2 | HBA: 4 | TPSA: 74.78 |
| #Bonds: 14 | #Rotatable Bonds: 5 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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