COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743062
Chemical Name: 3-{[(2E,5Z)-5-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: CCN1/C(=N\c2cccc(c2)C(=O)O)/S/C(=C\c2cc(Cl)c(c(c2)OC)O)/C1=O

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Molecular Weight: 432.88
Empirical Formula: C20H17ClN2O5S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 4.739
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 124
Number of rings: 3

     

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