COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL405744
Chemical Name: (2Z,5E)-2-[(2,5-dimethylphenyl)imino]-5-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-1,3-thiazolidin-4-one
Smiles: CCOc1cc(/C=C\2/S/C(=N\c3cc(C)ccc3C)/NC2=O)cc(c1O)I

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Molecular Weight: 494.35
Empirical Formula: C20H19IN2O3S

Physical State: Dry powder
Available Amount: 1413 mg

Lipinsky:
logP: 4.03
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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