COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297698
Chemical Name: pentyl4-[(5E)-5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: CCCCCOC(=O)CCCN1C(=S)S/C(=C/c2ccc(cc2)OC)/C1=O

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Molecular Weight: 407.55
Empirical Formula: C20H25NO4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.424
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 2

     

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