COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023849
Chemical Name: 5-(1,3-benzodioxol-5-ylmethylidene)-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(C)(OC(=O)/C/1=C\c1ccc2c(c1)OCO2)C(C)(C)C

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Molecular Weight: 318.33
Empirical Formula: C17H18O6

Physical State: Dry powder
Available Amount: 522 mg

Lipinsky:
logP: 2.216
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 3

     

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