COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124102
Chemical Name: 3-[(5E)-5-(4-hydroxy-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=S)S/C(=C/c2ccc(c(c2)[N+](=O)[O-])O)/C1=O

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Molecular Weight: 402.41
Empirical Formula: C17H10N2O6S2

Available Amount: 0 mg

Lipinsky:
logP: 3.994
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 181
Number of rings: 3

     

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