COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378599
Chemical Name: (5E)-3-(4-bromo-3-chlorophenyl)-5-(3-bromo-4-ethoxy-5-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1c(Br)cc(cc1OC)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)Cl)Br

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Molecular Weight: 563.72
Empirical Formula: C19H14Br2ClNO3S2

Physical State: Dry powder
Available Amount: 618 mg

Lipinsky:
logP: 6.844
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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