COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392862
Chemical Name: (5E)-5-(4-hydroxy-3,5-dimethoxybenzylidene)-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(cc2)[N+](=O)[O-])cc(c1O)OC

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Molecular Weight: 418.45
Empirical Formula: C18H14N2O6S2

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 3.06
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 162
Number of rings: 3

     

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