COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994534
Chemical Name: (5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-3-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)/N=C/c1cc(ccc1O)[N+](=O)[O-]

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Molecular Weight: 445.48
Empirical Formula: C19H15N3O6S2

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 4.79
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 185
Number of rings: 3

     

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