COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK331706
Chemical Name: ethyl2-(4-nitrophenyl)-2-(prop-2-en-1-yl)-1,3-dithiole-4-carboxylate
Smiles: C=CCC1(SC=C(S1)C(=O)OCC)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 337.42
Empirical Formula: C15H15NO4S2

Available Amount: 0 mg

Lipinsky:
logP: 5.056
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 122
Number of rings: 2

     

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