COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545153
Chemical Name: N-[(5Z)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-nitrobenzamide
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 459.5
Empirical Formula: C20H17N3O6S2

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 3.749
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 171
Number of rings: 3

     

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