COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551729
Chemical Name: 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)propanoicacid
Smiles: COc1cc(cc(c1O)OC)C(c1oc(C)cc(=O)c1O)CC(=O)O

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Molecular Weight: 350.33
Empirical Formula: C17H18O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.786
Rotatable bonds: 8
H-donors: 3
H-acceptors: 8
PSA: 122
Number of rings: 2

     

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