COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK102252
Chemical Name: (2E,5E)-5-[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxybenzylidene]-2-[(4-ethylphenyl)imino]-3-methyl-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1OCc1ccc2c(c1)OCO2)/C=C\1/S/C(=N/c2ccc(cc2)CC)/N(C1=O)C

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Molecular Weight: 516.62
Empirical Formula: C29H28N2O5S

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 7.31
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 94
Number of rings: 5

     

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