COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994306
Chemical Name: ethyl4-({3-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 484.55
Empirical Formula: C23H20N2O6S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.403
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 151
Number of rings: 4

     

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