COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811197
Chemical Name: (5Z)-3-(butan-2-yl)-5-(3,5-di-tert-butyl-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)/C1=O)C

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Molecular Weight: 405.63
Empirical Formula: C22H31NO2S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 6.119
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 2

     

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