COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443334
Chemical Name: methyl4-({[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 412.42
Empirical Formula: C20H16N2O6S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.281
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 119
Number of rings: 4

     

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