COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157913
Chemical Name: (2E,5Z)-2-[(4-ethoxyphenyl)imino]-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C/1\NC(=O)/C(=C/c2cc3OCOc3cc2[N+](=O)[O-])/S1

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Molecular Weight: 413.41
Empirical Formula: C19H15N3O6S

Physical State: Dry powder
Available Amount: 411 mg

Lipinsky:
logP: 2.832
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 140
Number of rings: 4

     

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