|
Ligand Download |
||
 | ||
| Ligand Name: 5-chloro thiophene-2-carboxylic acid | ||
| HET ID: 9E9 | PubChem: 95048 | |
| DrugBank: - | ChEMBL: CHEMBL4280438 | |
| Canonical SMILES: OC(=O)c1ccc(s1)Cl | ||
| Standard InChI: InChI=1S/C5H3ClO2S/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8) | ||
| Molecular Formula: C5H3ClO2S | Mol. Weight: 162.59412 | Heavy Atoms: 9 |
| Charge: 0 | Is Chiral: False | logP: 2.0997 |
| HBD: 1 | HBA: 3 | TPSA: 65.54 |
| #Bonds: 9 | #Rotatable Bonds: 1 | Shape Complexity: 0.0 |
| Stereocomplexity: 0.0 | ||