COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL370012
Chemical Name: (5E)-3-(4-ethoxyphenyl)-5-[3-nitro-4-(piperidin-1-yl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)N1C(=S)S/C(=C/c2ccc(c(c2)[N+](=O)[O-])N2CCCCC2)/C1=O

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Molecular Weight: 469.59
Empirical Formula: C23H23N3O4S2

Physical State: Dry powder
Available Amount: 1165 mg

Lipinsky:
logP: 7.163
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 135
Number of rings: 4

     

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