COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994793
Chemical Name: 2-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoicacid
Smiles: COc1cc(ccc1OC)/C=C\1/SC(=S)N(C1=O)C(C(=O)O)C(C)C

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Molecular Weight: 381.47
Empirical Formula: C17H19NO5S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.729
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 2

     

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