COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192476
Chemical Name: 3-[(5E)-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4,6-dioxo-2-thioxotetrahydropyrimidin-1(2H)-yl]benzoicacid
Smiles: CCOc1cc2OCOc2cc1/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)C(=O)O

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Molecular Weight: 440.43
Empirical Formula: C21H16N2O7S

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 3.59
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 4

     

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