COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK070017
Chemical Name: 2,4-dichloro-6-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl4-methylbenzenesulfonate
Smiles: C=CCN1C(=S)S/C(=C\c2cc(Cl)cc(c2OS(=O)(=O)c2ccc(cc2)C)Cl)/C1=O

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Molecular Weight: 500.45
Empirical Formula: C20H15Cl2NO4S3

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 5.458
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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