COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374375
Chemical Name: ethyl4-{[(2E,5Z)-5-(4-hydroxy-3-nitrobenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2ccc(c(c2)[N+](=O)[O-])O)/C(=O)N1C

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Molecular Weight: 427.44
Empirical Formula: C20H17N3O6S

Physical State: Dry powder
Available Amount: 737 mg

Lipinsky:
logP: 5.185
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 150
Number of rings: 3

     

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