COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065690
Chemical Name: (5E)-5-(2,3-dibromo-5-ethoxy-4-hydroxybenzylidene)-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C/c2cc(OCC)c(c(c2Br)Br)O)/C1=O

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Molecular Weight: 479.21
Empirical Formula: C15H13Br2NO3S2

Physical State: Dry powder
Available Amount: 163 mg

Lipinsky:
logP: 4.938
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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