COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994257
Chemical Name: 5-({3-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 472.5
Empirical Formula: C21H16N2O7S2

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 3.559
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 182
Number of rings: 4

     

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