COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK812144
Chemical Name: (5Z)-3-(butan-2-yl)-5-(2-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2ccccc2[N+](=O)[O-])/C1=O)C

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Molecular Weight: 322.41
Empirical Formula: C14H14N2O3S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.828
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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