COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK796750
Chemical Name: 2-tert-butyl-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-methyl-1,3-dioxane-4,6-dione
Smiles: CC(C1(C)OC(=O)/C(=C/c2ccc(o2)Sc2ccc(cc2)Cl)/C(=O)O1)(C)C

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Molecular Weight: 406.89
Empirical Formula: C20H19ClO5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.083
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 91
Number of rings: 3

     

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