COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK750851
Chemical Name: methyl4-({[(5E)-5-(2,3-dichlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]methyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NCN1C(=S)S/C(=C/c2cccc(c2Cl)Cl)/C1=O

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Molecular Weight: 453.37
Empirical Formula: C19H14Cl2N2O3S2

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 4.486
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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