COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155588
Chemical Name: (2E,5E)-5-(2-bromo-3-chloro-5-ethoxy-4-hydroxybenzylidene)-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one
Smiles: CC/N=C\1/S/C(=C/c2cc(OCC)c(c(c2Br)Cl)O)/C(=O)N1CC

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Molecular Weight: 433.75
Empirical Formula: C16H18BrClN2O3S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 4.298
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 2

     

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