COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861790
Chemical Name: (5Z)-5-(2,6-dichlorobenzylidene)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3c(Cl)cccc3Cl)/C2=O)ccc1OC

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Molecular Weight: 454.4
Empirical Formula: C20H17Cl2NO3S2

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 4.567
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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