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Ligand Name: 4-bromo-3-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl fluoride |
Ligand Type: non-polymer |
Ligand ID: COVPDB46 |
PubChem:
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Synonym(s):
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DrugBank: - |
ChEMBL: - |
Canonical SMILES: Oc1c(Cl)cc(cc1Cl)-c1nnc(o1)-c1cc(ccc1Br)S(F)(=O)=O |
Standard InChI: InChI=1S/C14H6BrCl2FN2O4S/c15-9-2-1-7(25(18,22)23)5-8(9)14-20-19-13(24-14)6-3-10(16)12(21)11(17)4-6/h1-5,21H |
Molecular Formula: C14H6BrCl2FN2O4S |
Mol. Weight: 465.85928 |
logP: 4.8367 |
HBD: 1 | HBA: 6 |
#Rotatable Bonds: 3 | TPSA: 93.29 |