COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK842374
Chemical Name: methyl4-[(5E)-5-(4-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=S)S/C(=C/c2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 400.44
Empirical Formula: C18H12N2O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.213
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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