COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382432
Chemical Name: (2E,5E)-2-[(4-ethoxyphenyl)imino]-5-(2-methoxy-5-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C/1\NC(=O)/C(=C\c2cc(ccc2OC)[N+](=O)[O-])/S1

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 2.824
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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