COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071158
Chemical Name: diethyl2,5-bis(3-ethoxy-3-oxoprop-1-yn-1-yl)benzene-1,4-dicarboxylate
Smiles: CCOC(=O)c1cc(C#CC(=O)OCC)c(cc1C#CC(=O)OCC)C(=O)OCC

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Molecular Weight: 414.41
Empirical Formula: C22H22O8

Available Amount: 0 mg

Lipinsky:
logP: 6.537
Rotatable bonds: 10
H-donors: 0
H-acceptors: 8
PSA: 105
Number of rings: 1

     

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