COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK991778
Chemical Name: methyl2-{[(E)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]amino}benzoate
Smiles: COC(=O)c1ccccc1N/C=C\1/SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 458.56
Empirical Formula: C22H22N2O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.795
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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