COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369207
Chemical Name: (5Z)-3-(2-methoxyethyl)-5-{4-[(3-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: COCCN1C(=S)S/C(=C\c2ccc(cc2)OCc2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 430.51
Empirical Formula: C20H18N2O5S2

Physical State: Dry powder
Available Amount: 937 mg

Lipinsky:
logP: 3.209
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 141
Number of rings: 3

     

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