COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK159668
Chemical Name: (2Z,5Z)-2-[(3,5-dimethylphenyl)imino]-5-(2-hydroxy-3,5-dinitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: Cc1cc(C)cc(c1)/N=C\1/NC(=O)/C(=C/c2cc(cc(c2O)[N+](=O)[O-])[N+](=O)[O-])/S1

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Molecular Weight: 414.4
Empirical Formula: C18H14N4O6S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.933
Rotatable bonds: 2
H-donors: 2
H-acceptors: 6
PSA: 178
Number of rings: 3

     

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