COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546297
Chemical Name: methyl4-[(5Z)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=S)S/C(=C\c2cc(OC)c(c(c2)[N+](=O)[O-])O)/C1=O

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Molecular Weight: 446.46
Empirical Formula: C19H14N2O7S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.364
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 179
Number of rings: 3

     

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