COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036015
Chemical Name: methyl4-[(5Z)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: COC(=O)CCCN1C(=S)S/C(=C\c2ccc(c(c2)OC)OC)/C1=O

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Molecular Weight: 381.47
Empirical Formula: C17H19NO5S2

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 2.181
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 2

     

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