COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152256
Chemical Name: methyl{(5E)-5-[4-(benzyloxy)-5-methoxy-2-nitrobenzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
Smiles: COC(=O)CN1C(=O)S/C(=C/c2cc(OC)c(cc2[N+](=O)[O-])OCc2ccccc2)/C1=O

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Molecular Weight: 458.45
Empirical Formula: C21H18N2O8S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.173
Rotatable bonds: 7
H-donors: 0
H-acceptors: 8
PSA: 153
Number of rings: 3

     

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