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| Ligand Name: 3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB45 |
PubChem:
136266605
|
Synonym(s):
- 1422569-98-9
- 3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazole-2-yl]benzenesulfonic acid fluoride
show 1 synonym(s)
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| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: Oc1c(Cl)cc(cc1Cl)-c1nnc(o1)-c1cccc(c1)S(F)(=O)=O |
| Standard InChI: InChI=1S/C14H7Cl2FN2O4S/c15-10-5-8(6-11(16)12(10)20)14-19-18-13(23-14)7-2-1-3-9(4-7)24(17,21)22/h1-6,20H |
| Molecular Formula: C14H7Cl2FN2O4S |
Mol. Weight: 387.94876 |
logP: 4.0742 |
| HBD: 1 | HBA: 6 |
| #Rotatable Bonds: 3 | TPSA: 93.29 |