COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809209
Chemical Name: (5E)-5-(4-tert-butylbenzylidene)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1OC)CCN1C(=S)S/C(=C/c2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 441.62
Empirical Formula: C24H27NO3S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 5.486
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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