COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK727626
Chemical Name: 4-{[(2Z,5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: CCN1/C(=N/c2ccc(cc2)C(=O)O)/S/C(=C/c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 396.42
Empirical Formula: C20H16N2O5S

Physical State: Dry powder
Available Amount: 254 mg

Lipinsky:
logP: 5.143
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 4

     

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