COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994886
Chemical Name: 3-{(5Z)-5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C(\c2ccc(c(c2)C)C)/C)/C1=O

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Molecular Weight: 335.45
Empirical Formula: C16H17NO3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.147
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 2

     

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