COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538669
Chemical Name: ethyl3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)propanoate
Smiles: CCOC(=O)CC(c1oc(CO)cc(=O)c1O)c1cc(OC)c2c(c1)OCCO2

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Molecular Weight: 406.39
Empirical Formula: C20H22O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.172
Rotatable bonds: 10
H-donors: 2
H-acceptors: 9
PSA: 120
Number of rings: 3

     

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