COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL159002
Chemical Name: methyl4-{3-ethoxy-1-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-oxopropyl}benzoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 376.36
Empirical Formula: C19H20O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.782
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 119
Number of rings: 2

     

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