COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861901
Chemical Name: 2-[(5Z)-5-(3,4-dichlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: S=C1S/C(=C\c2ccc(c(c2)Cl)Cl)/C(=O)N1CCS(=O)(=O)O

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Molecular Weight: 398.31
Empirical Formula: C12H9Cl2NO4S3

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 1.074
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 2

     

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