COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000596
Chemical Name: 4,4'- (1,1- dioxido- 3H- 2,1- benzoxathiole- 3,3- diyl)diphenol
Smiles: Oc1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 354.38
Empirical Formula: C19H14O5S

Physical State: Dry powder
Available Amount: 3158 mg

Lipinsky:
logP: 3.02
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 92
Number of rings: 4

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